SCHEMBL2736105

SCHEMBL2736105

CC(C)CCNS(C)(=O)=O

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.40
ALDH1A1 P00352 5/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HTT P42858 3/20 0.37
POLB P06746 1/20 0.36
GRIA1 P42261 3/20 0.36
MAPT P10636 1/20 0.34
ALOX15 P16050 1/20 0.33
GRIA4 P48058 1/20 0.33

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
SCHEMBL9973632 0.86 KMT2A (0.33) KMT2AALDH1A1SMN1; SMN2HTTPOLB
SCHEMBL3433536 0.85 GRIA1 (0.43) KMT2AALDH1A1HTTPOLBGRIA1
SCHEMBL4762362 0.83 GRIA1 (0.46) KMT2AALDH1A1HTTPOLBGRIA1
SCHEMBL12967013 0.81 GRIA1 (0.50) ALDH1A1POLBGRIA1
SCHEMBL14318444 0.81 GRIA1 (0.50) ALDH1A1POLBGRIA1
SCHEMBL21696396 0.78 KMT2A (0.34) KMT2AALDH1A1SMN1; SMN2HTT
SCHEMBL1300241 0.77 GRIA1 (0.39) KMT2AALDH1A1SMN1; SMN2HTTPOLB
SCHEMBL18198023 0.77 GRIA1 (0.62) KMT2AALDH1A1SMN1; SMN2HTTGRIA1
SCHEMBL966015 0.77 CA1 (0.50) KMT2AALDH1A1SMN1; SMN2HTTGRIA1
SCHEMBL19996824 0.77 KMT2A (0.39) KMT2AALDH1A1SMN1; SMN2HTTGRIA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1505063-A1 BENZIMIDAZOLE DERIVATIVES BANYU PHARMACEUTICAL CO., LTD. (JP) 2005-02-09 EP claimed
US-20030236267-A1 Benzimidazole derivatives MSD K.K. (JP) 2003-12-25 US claimed
US-11873291-B2 Quinoline cGAS antagonist compounds IMMUNESENSOR THERAPEUTICS, INC. (US) 2024-01-16 US disclosed
US-11858931-B2 Amino acid compounds with unbranched linkers and methods of use PLIANT THERAPEUTICS, INC. (US) 2024-01-02 US disclosed
US-11858931-B2 Amino acid compounds with unbranched linkers and methods of use PLIANT THERAPEUTICS, INC. (US) 2024-01-02 US disclosed
WO-2023230540-A2 INDAZOLE DERIVATIVES FOR TREATING TRPM3-MEDIATED DISORDERS KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2023-11-30 WO disclosed
WO-2023230543-A1 INDOLIZINE DERIVATIVES FOR TREATING TRPM3-MEDIATED DISORDERS KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2023-11-30 WO disclosed
WO-2023230542-A2 PYRAZOLO[1,5-a]PYRIDINE DERIVATIVES FOR TREATING TRPM3-MEDIATED DISORDERS KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2023-11-30 WO disclosed
US-20230365568-A1 PLK1 POLO BOX DOMAIN INHIBITORS AND METHOD OF TREATING CANCER THE UNITED STATES OF AMERICA,AS REPRESENTED BY THE SECRETARY,DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2023-11-16 US disclosed
US-20230357158-A1 QUINOLINE cGAS ANTAGONIST COMPOUNDS THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM 2023-11-09 US disclosed
WO-2023196432-A1 CHEMOKINE RECEPTOR MODULATORS AND USES THEREOF RAPT THERAPEUTICS, INC. (US) 2023-10-12 WO disclosed
US-20080207620-A1 MODULATORS OF PHARMACOKINETIC PROPERTIES OF THERAPEUTICS GILEAD SCIENCES, INC. 2008-08-28 US disclosed
US-20080108617-A1 co-administered drug (as HIV protease inhibiting compound, an HIV (non)nucleoside/nucleotide inhibitor of reverse transcriptase, capsid polymerization inhibitor, interferon, ribavirin analog) by inhibiting cytochrome P450 monooxygenase; ureido- or amido-amine derivatives; side effect reduction GILEAD SCIENCES, INC. 2008-05-08 US disclosed
US-20070249629-A1 Viral Polymerase Inhibitors BEAULIEU PIERRE 2007-10-25 US disclosed
WO-2007084319-A2 DIARYL PIPERIDINES AS CB1 MODULATORS SCHERING CORPORATION (US) 2007-07-26 WO disclosed
US-7241801-B2 Viral polymerase inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2007-07-10 US disclosed
US-7160890-B2 Compounds specific to adenosine A3 receptor and uses thereof OSI PHARMACEUTICALS, INC. (US) 2007-01-09 US disclosed
US-7125877-B2 Benzimidazole derivatives BANYU PHARMACEUTICAL CO., LTD. (JP) 2006-10-24 US disclosed
EP-1505063-A1 BENZIMIDAZOLE DERIVATIVES BANYU PHARMACEUTICAL CO., LTD. (JP) 2005-02-09 EP disclosed
US-20030236267-A1 Benzimidazole derivatives MSD K.K. (JP) 2003-12-25 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 (8 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-20080108617-A1 co-administered drug (as HIV protease inhibiting compound, an HIV (non)nucleoside/nucleotide inhibitor of reverse transcriptase, capsid polymerization inhibitor, interferon, ribavirin analog) by inhibiting cytochrome P450 monooxygenase; ureido- or amido-amine derivatives; side effect reduction PNP, UNG, PNPO KMT2A 4165/4885ALDH1A1 1720/4885SMN1; SMN2 3501/4885
US-20080207620-A1 MODULATORS OF PHARMACOKINETIC PROPERTIES OF THERAPEUTICS SLC10A1, SLC10A2, SLC26A4 KMT2A 4509/4885ALDH1A1 1466/4885SMN1; SMN2 581/4885
US-11873291-B2 Quinoline cGAS antagonist compounds CGAS, GLS2, GLS KMT2A 4371/4885ALDH1A1 4236/4885SMN1; SMN2 2633/4885
US-20030236267-A1 Benzimidazole derivatives OPRL1, GPR119, NPBWR1 KMT2A 3564/4885ALDH1A1 1636/4885SMN1; SMN2 2200/4885
US-20230357158-A1 QUINOLINE cGAS ANTAGONIST COMPOUNDS CGAS, GLS2, GLS KMT2A 4371/4885ALDH1A1 4236/4885SMN1; SMN2 2633/4885
US-20070249629-A1 Viral Polymerase Inhibitors RPP30, POLR2A, POLR1E KMT2A 2900/4885ALDH1A1 2153/4885SMN1; SMN2 2418/4885
US-11858931-B2 Amino acid compounds with unbranched linkers and methods of use ITGA2B, ITGB6, ITGB1 KMT2A 1467/4885ALDH1A1 2694/4885SMN1; SMN2 1460/4885
US-20230365568-A1 PLK1 POLO BOX DOMAIN INHIBITORS AND METHOD OF TREATING CANCER PLK1, PLK4, BUB1B KMT2A 1542/4885ALDH1A1 4253/4885SMN1; SMN2 2933/4885

“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.