SCHEMBL1592991

SCHEMBL1592991

N=C(N)Nc1cccc([N+](=O)[O-])c1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.68
MAPT P10636 4/20 0.68
POLB P06746 3/20 0.68
MEN1 O00255 3/20 0.68
DDX3X O00571 1/20 0.68
HTT P42858 1/20 0.68
CTDSP1 Q9GZU7 1/20 0.68
SMN1; SMN2 Q16637 2/20 0.64
BLM P54132 1/20 0.60
ALDH1A1 P00352 4/20 0.59
PRSS1 P07477 1/20 0.57
PRSS2 P07478 1/20 0.57
PRSS3 P35030 1/20 0.57
CA12 O43570 2/20 0.56
CA1 P00915 2/20 0.56
CA2 P00918 2/20 0.56
CA9 Q16790 2/20 0.56
CA5A P35218 1/20 0.56
CA5B Q9Y2D0 1/20 0.56
GAA P10253 1/20 0.55

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
Hydrochloric Acid SCHEMBL1592637 0.98 KMT2A (0.66) KMT2AMAPTPOLBMEN1DDX3X
Nitric Acid SCHEMBL2283510 0.97 KMT2A (0.64) KMT2AMAPTPOLBMEN1DDX3X
SCHEMBL6725074 0.86 KMT2A (0.72) KMT2AMAPTPOLBMEN1DDX3X
SCHEMBL14170 0.85 KMT2A (0.75) KMT2AMAPTPOLBMEN1DDX3X
SCHEMBL10518161 0.84 KMT2A (0.55) KMT2AMAPTPOLBMEN1DDX3X
SCHEMBL1880400 0.83 POLB (0.68) KMT2AMAPTPOLBMEN1DDX3X
SCHEMBL29838541 0.83 POLB (0.68) KMT2AMAPTPOLBMEN1DDX3X
SCHEMBL7865709 0.83 SMN1; SMN2 (0.73) KMT2AMAPTPOLBMEN1DDX3X
SCHEMBL11582992 0.83 POLB (0.63) KMT2AMAPTPOLBMEN1DDX3X
SCHEMBL1047211 0.81 MEN1 (1.00) KMT2AMAPTPOLBMEN1DDX3X

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4610262-A1 MACROCYCLIC COMPOUND AS CDK9 INHIBITOR AND USE THEREOF Artivila Biopharma (CN) 2025-09-03 EP disclosed
WO-2024088189-A1 MACROCYCLIC COMPOUND AS CDK9 INHIBITOR AND USE THEREOF 科辉智药生物科技(无锡)有限公司 2024-05-02 WO disclosed
EP-3621952-A1 METHOD FOR THE PRODUCTION OF PHENYLGUANIDINES OR THE SALTS THEREOF AlzChem Trostberg GmbH (DE) 2020-03-18 EP disclosed
WO-2018210633-A1 METHOD FOR THE PRODUCTION OF PHENYLGUANIDINES OR THE SALTS THEREOF ALZCHEM TROSTBERG GMBH (DE) 2018-11-22 WO disclosed
US-9944641-B2 Isoquinolinone derivatives useful in the treatment of cancer PIERRE FABRE MEDICAMENT (FR) 2018-04-17 US disclosed
US-9944641-B2 Isoquinolinone derivatives useful in the treatment of cancer PIERRE FABRE MEDICAMENT (FR) 2018-04-17 US disclosed
US-9944641-B2 Isoquinolinone derivatives useful in the treatment of cancer PIERRE FABRE MEDICAMENT (FR) 2018-04-17 US disclosed
US-20170240544-A1 ISOQUINOLINONE DERIVATIVES USEFUL IN THE TREATMENT OF CANCER PIERRE FABRE MEDICAMENT (FR) 2017-08-24 US disclosed
US-20170240544-A1 ISOQUINOLINONE DERIVATIVES USEFUL IN THE TREATMENT OF CANCER PIERRE FABRE MEDICAMENT (FR) 2017-08-24 US disclosed
US-20170240544-A1 ISOQUINOLINONE DERIVATIVES USEFUL IN THE TREATMENT OF CANCER PIERRE FABRE MEDICAMENT (FR) 2017-08-24 US disclosed
WO-2003051886-A1 PYRAZOLOPYRIDAZINE DERIVATIVES SMITHKLINE BEECHAM CORPORATION (US) 2003-06-26 WO disclosed
US-20030096816-A1 Inhibitors of c-Jun N-terminal kinases (JNK) and other protein kinases VERTEX PHARMACEUTICALS INCORPORATED 2003-05-22 US disclosed
US-20030036529-A1 Compositions and methods for inhibiting arginase activity THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2003-02-20 US disclosed
WO-2003004492-A1 ISOXAZOLYL-PYRIMIDINES AS INHIBITORS OF SRC AND LCK PROTEIN KINASES VERTEX PHARMACEUTICALS INCORPORATED (US) 2003-01-16 WO disclosed
WO-2002083667-A2 INHIBITORS OF C-JUN N-TERMINAL KINASES (JNK) AND OTHER PROTEIN KINASES VERTEX PHARMACEUTICALS INCORPORATED (US) 2002-10-24 WO disclosed
US-6387890-B1 CARDIOVASCULAR DISORDERS; GASTROINTESTINAL DISORDERS; SEXUAL DISORDERS TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA 2002-05-14 US disclosed
EP-1049660-A1 COMPOSITIONS AND METHODS FOR INHIBITING ARGINASE ACTIVITY THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2000-11-08 EP disclosed
CN-1043531-C Pyrimidine derivatives and a process for production thereof NOVATIS AG (CH) 1999-06-02 CN disclosed
WO-1999019295-A1 COMPOSITIONS AND METHODS FOR INHIBITING ARGINASE ACTIVITY TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 1999-04-22 WO disclosed
CN-1077713-A Pyrimidine derivatives and preparation method thereof CIBA GEIGY AG (CH) 1993-10-27 CN 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 (2 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-20030096816-A1 Inhibitors of c-Jun N-terminal kinases (JNK) and other protein kinases LCK, MAPK1, MAP3K1 KMT2A 3261/4885MAPT 2790/4885POLB 3108/4885
US-20170240544-A1 ISOQUINOLINONE DERIVATIVES USEFUL IN THE TREATMENT OF CANCER TP53, KRAS, AQP1 KMT2A 1365/4885MAPT 2029/4885POLB 925/4885

“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.