SCHEMBL10089701

SCHEMBL10089701

CCc1ccc([N+](=O)[O-])c2nonc12

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GSTM2 P28161 10/20 0.56
▸ GSTP1 P09211 9/20 0.56
▸ MEN1 O00255 5/20 0.52
▸ KMT2A Q03164 5/20 0.52
▸ NPC1 O15118 1/20 0.52
▸ RAB9A P51151 1/20 0.52
▸ IDO1 P14902 5/20 0.51
▸ USP2 O75604 2/20 0.50
▸ G6PD P11413 1/20 0.50
▸ CASP6 P55212 1/20 0.50
▸ POLB P06746 1/20 0.50
▸ TNNI3 P19429 1/20 0.50
▸ TNNT2 P45379 1/20 0.50
▸ TNNC1 P63316 1/20 0.50
▸ MYC P01106 1/20 0.50
▸ HTT P42858 1/20 0.50
▸ RECQL P46063 1/20 0.50
▸ ALDH1A1 P00352 1/20 0.49
▸ CYP2D6 P10635 1/20 0.49
▸ CYP2C9 P11712 1/20 0.49

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7052057 0.85 GSTM2 (0.66) GSTM2GSTP1MEN1KMT2AIDO1
SCHEMBL8788825 0.85 GSTM2 (0.51) GSTM2GSTP1MEN1KMT2AIDO1
SCHEMBL25868523 0.84 GSTM2 (0.51) GSTM2GSTP1MEN1KMT2ANPC1
SCHEMBL2608494 0.80 GSTP1 (0.61) GSTM2GSTP1MEN1KMT2AIDO1
SCHEMBL3501548 0.80 MEN1 (0.60) GSTM2GSTP1MEN1KMT2ANPC1
SCHEMBL28945749 0.78 GSTM2 (0.46) GSTM2GSTP1MEN1KMT2ANPC1
SCHEMBL3500091 0.78 MEN1 (0.60) GSTM2GSTP1MEN1KMT2ANPC1
SCHEMBL1076589 0.78 MEN1 (0.60) GSTM2GSTP1MEN1KMT2ANPC1
SCHEMBL17781757 0.78 MEN1 (0.67) GSTM2GSTP1MEN1KMT2ANPC1
SCHEMBL17914175 0.76 MEN1 (0.63) GSTM2GSTP1MEN1KMT2ANPC1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 26 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240067952-A1 REPROGRAMMING UROKINASE INTO AN ANTIBODY-RECRUITING ANTICANCER AGENT UNIV YALE (US) 2024-02-29 — — US disclosed
US-20240067756-A1 CHIMERIC SMALL MOLECULES FOR THE RECRUITMENT OF ANTIBODIES TO CANCER CELLS UNIV YALE (US) 2024-02-29 — — US disclosed
US-11858917-B2 Bifunctional molecules with antibody-recruiting and entry inhibitory activity against the human immunodeficiency virus YALE UNIVERSITY (US) 2024-01-02 — — US disclosed
US-11767301-B2 Bi-functional molecules to degrade circulating proteins YALE UNIVERSITY (US) 2023-09-26 — — US disclosed
US-11725064-B2 Chimeric small molecules for the recruitment of antibodies to cancer cells YALE UNIVERSITY (US) 2023-08-15 — — US disclosed
US-10030008-B2 Bifunctional molecules with antibody-recruiting and entry inhibitory activity against the human immunodeficiency virus YALE UNIVERSITY (US) 2018-07-24 — — US disclosed
US-10016412-B2 TLR-agonist-conjugated antibody recruiting molecules (TLR-ARMs) YALE UNIVERSITY (US) 2018-07-10 — — US disclosed
US-20180155332-A1 SMALL MOLECULE BASED ANTIBODY-RECRUITING COMPOUNDS FOR CANCER TREATMENT YALE UNIVERSITY 2018-06-07 — — US disclosed
US-20170096415-A1 BIFUNCTIONAL MOLECULES WITH ANTIBODY-RECRUITING AND ENTRY INHIBITORY ACTIVITY AGAINST THE HUMAN IMMUNODEFICIENCY VIRUS UNIV YALE (US) 2017-04-06 — — US disclosed
US-20170087148-A1 TLR-AGONIST-CONJUGATED ANTIBODY RECRUITING MOLECULES (TLR-ARMs) UNIV YALE (US) 2017-03-30 — — US disclosed
US-9181224-B2 Bifunctional molecules with antibody-recruiting and entry inhibitory activity against the human immunodeficiency virus YALE UNIVERSITY (US) 2015-11-10 — — US disclosed
US-20150110742-A1 TLR-AGONIST-CONJUGATED ANTIBODY RECRUITING MOLECULES (TLR-ARMS) YALE UNIVERSITY (US) 2015-04-23 — — US disclosed
US-20140308342-A1 REPROGRAMMING UROKINASE INTO AN ANTIBODY-RECRUITING ANTICANCER AGENT NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2014-10-16 — — US disclosed
US-8859509-B2 Chimeric small molecules for the recruitment of antibodies to cancer cells YALE UNIVERSITY (US) 2014-10-14 — — US disclosed
US-8852630-B2 Chimeric small molecules for the recruitment of antibodies to cancer cells YALE UNIVERSITY (US) 2014-10-07 — — US disclosed
US-20130245040-A1 BIFUNCTIONAL MOLECULES WITH ANTIBODY-RECRUITING AND ENTRY INHIBITORY ACTIVITY AGAINST THE HUMAN IMMUNODEFICIENCY VIRUS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2013-09-19 — — US disclosed
US-20120269766-A1 BIFUNCTIONAL MOLECULES WITH ANTIBODY-RECRUITING AND ENTRY INHIBITORY ACTIVITY AGAINST THE HUMAN IMMUNODEFICIENCY VIRUS YALE UNIVERSITY (US) 2012-10-25 — — US disclosed
US-20120034295-A1 CHIMERIC SMALL MOLECULES FOR THE RECRUITMENT OF ANTIBODIES TO CANCER CELLS YALE UNIVERSITY 2012-02-09 — — US disclosed
US-20110201563-A1 CHIMERIC SMALL MOLECULES FOR THE RECRUITMENT OF ANTIBODIES TO CANCER CELLS YALE UNIVERSITY (US) 2011-08-18 — — US disclosed
US-20080262254-A1 Sphingolipids ETTMAYER PETER 2008-10-23 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (17 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20140308342-A1 REPROGRAMMING UROKINASE INTO AN ANTIBODY-RECRUITING ANTICANCER AGENT PLAUR, CD47, CD14 GSTM2 1267/4885GSTP1 2170/4885MEN1 2894/4885
US-11767301-B2 Bi-functional molecules to degrade circulating proteins MIF, ASGR1, FCGR2A GSTM2 163/4885GSTP1 207/4885MEN1 1417/4885
US-11725064-B2 Chimeric small molecules for the recruitment of antibodies to cancer cells BRDT, PAICS, KLK3 GSTM2 453/4885GSTP1 502/4885MEN1 1313/4885
US-10016412-B2 TLR-agonist-conjugated antibody recruiting molecules (TLR-ARMs) TLR3, TLR4, TLR1 GSTM2 1175/4885GSTP1 970/4885MEN1 3416/4885
US-20120034295-A1 CHIMERIC SMALL MOLECULES FOR THE RECRUITMENT OF ANTIBODIES TO CANCER CELLS BRDT, PAICS, KLK3 GSTM2 453/4885GSTP1 502/4885MEN1 1313/4885
US-20180155332-A1 SMALL MOLECULE BASED ANTIBODY-RECRUITING COMPOUNDS FOR CANCER TREATMENT PLAUR, C5AR1, C3AR1 GSTM2 2446/4885GSTP1 2941/4885MEN1 1364/4885
US-20170087148-A1 TLR-AGONIST-CONJUGATED ANTIBODY RECRUITING MOLECULES (TLR-ARMs) TLR3, TLR4, TLR1 GSTM2 1175/4885GSTP1 970/4885MEN1 3416/4885
US-20150110742-A1 TLR-AGONIST-CONJUGATED ANTIBODY RECRUITING MOLECULES (TLR-ARMS) TLR3, TLR4, TLR1 GSTM2 1175/4885GSTP1 970/4885MEN1 3416/4885
US-20080262254-A1 Sphingolipids SGMS2, SGMS1, SGPL1 GSTM2 2272/4885GSTP1 2292/4885MEN1 376/4885
US-20240067952-A1 REPROGRAMMING UROKINASE INTO AN ANTIBODY-RECRUITING ANTICANCER AGENT PLAUR, CD47, CD14 GSTM2 1267/4885GSTP1 2170/4885MEN1 2894/4885
US-10030008-B2 Bifunctional molecules with antibody-recruiting and entry inhibitory activity against the human immunodeficiency virus CD4, HAVCR2, CD2 GSTM2 537/4885GSTP1 1085/4885MEN1 3370/4885
US-11858917-B2 Bifunctional molecules with antibody-recruiting and entry inhibitory activity against the human immunodeficiency virus CD4, HAVCR2, CD2 GSTM2 537/4885GSTP1 1085/4885MEN1 3370/4885
US-20120269766-A1 BIFUNCTIONAL MOLECULES WITH ANTIBODY-RECRUITING AND ENTRY INHIBITORY ACTIVITY AGAINST THE HUMAN IMMUNODEFICIENCY VIRUS CD4, HAVCR2, CD2BP2 GSTM2 435/4885GSTP1 1101/4885MEN1 3119/4885
US-20170096415-A1 BIFUNCTIONAL MOLECULES WITH ANTIBODY-RECRUITING AND ENTRY INHIBITORY ACTIVITY AGAINST THE HUMAN IMMUNODEFICIENCY VIRUS CD4, HAVCR2, CD2 GSTM2 537/4885GSTP1 1085/4885MEN1 3370/4885
US-20110201563-A1 CHIMERIC SMALL MOLECULES FOR THE RECRUITMENT OF ANTIBODIES TO CANCER CELLS BRDT, PAICS, KLK3 GSTM2 453/4885GSTP1 502/4885MEN1 1313/4885
US-20240067756-A1 CHIMERIC SMALL MOLECULES FOR THE RECRUITMENT OF ANTIBODIES TO CANCER CELLS BRDT, PAICS, KLK3 GSTM2 453/4885GSTP1 502/4885MEN1 1313/4885
US-20130245040-A1 BIFUNCTIONAL MOLECULES WITH ANTIBODY-RECRUITING AND ENTRY INHIBITORY ACTIVITY AGAINST THE HUMAN IMMUNODEFICIENCY VIRUS CD4, HAVCR2, CD2 GSTM2 537/4885GSTP1 1085/4885MEN1 3370/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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