SCHEMBL509167

SCHEMBL509167

NCc1ccc(C(N)=O)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 2/20 0.60
F10 P00742 1/20 0.60
PLA2G10 O15496 1/20 0.59
PLA2G2A P14555 1/20 0.59
HDAC3 O15379 1/20 0.59
HDAC6 Q9UBN7 1/20 0.59
NCOR2 Q9Y618 1/20 0.59
PARP10 Q53GL7 5/20 0.55
PLAU P00749 1/20 0.54
ALDH1A1 P00352 1/20 0.50
KMT2A Q03164 1/20 0.50
PARP15 Q460N3 1/20 0.50
PARP14 Q460N5 1/20 0.50
PARP16 Q8N5Y8 1/20 0.50
PARP11 Q9NR21 1/20 0.50
PARP4 Q9UKK3 1/20 0.50
ABAT P80404 1/20 0.50
POLB P06746 1/20 0.50
CYP3A4 P08684 1/20 0.50
PARP1 P09874 1/20 0.50

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
Terephthalamide SCHEMBL3444098 1.00 LOXL2 (0.60) LOXL2F10PLA2G10PLA2G2AHDAC3
Hydrochloric Acid SCHEMBL3948480 0.98 LOXL2 (0.58) LOXL2F10PLA2G10PLA2G2AHDAC3
Hydrochloric Acid SCHEMBL31474725 0.98 LOXL2 (0.58) LOXL2F10PLA2G10PLA2G2AHDAC3
SCHEMBL755049 0.88 PARP10 (0.73) LOXL2PARP10ALDH1A1KMT2APARP15
Terephthalamide SCHEMBL9842226 0.87 PLA2G10 (0.57) LOXL2F10PLA2G10PLA2G2AHDAC3
Terephthalamide SCHEMBL28419789 0.85 PLAU (0.59) LOXL2F10PLA2G10PLA2G2AHDAC3
Benzamide SCHEMBL27536269 0.84 PARP1 (0.70) LOXL2PLA2G10PLA2G2APARP10POLB
Terephthalamide SCHEMBL8931235 0.84 PARP1 (0.60) PLA2G10PLA2G2APARP10ALDH1A1KMT2A
SCHEMBL19853627 0.83 NQO2 (0.52) PLA2G10PLA2G2AHDAC3HDAC6NCOR2
SCHEMBL7493555 0.83 HDAC3 (0.57) LOXL2F10PLA2G10PLA2G2AHDAC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2943483-A1 BENZYLAMINE DERIVATIVES Kalvista Pharmaceuticals Limited (GB) 2015-11-18 EP claimed
EP-1937652-B1 PYRIMIDINE AMIDE COMPOUNDS AS PGDS INHIBITORS AVENTIS PHARMA INC (US) 2014-07-30 EP claimed
WO-2014108679-A1 BENZYLAMINE DERIVATIVES KALVISTA PHARMACEUTICALS LIMITED (GB) 2014-07-17 WO claimed
US-8729089-B2 Pyrido(3,2-d)pyrimidines useful for treating viral infections GILEAD SCIENCES, INC. (US) 2014-05-20 US claimed
US-8354444-B2 Substituted pyrrolidine-2-carboxamides HOFFMANN-LA ROCHE INC. (US) 2013-01-15 US claimed
EP-2534132-A1 SUBSTITUTED PYRROLIDINE-2-CARBOXAMIDES F. Hoffmann-La Roche AG (CH) 2012-12-19 EP claimed
US-20100190773-A1 Anti-Cytokine Heterocyclic Compounds BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-07-29 US claimed
US-20100152190-A1 Substituted Pyrrolidine-2-Carboxamides F. HOFFMANN-LA ROCHE AG (CH) 2010-06-17 US claimed
EP-2188289-A2 (7H-PYRROLO[2,3-D]PYRIMIDIN-4-YL)-PIPERAZINES AS KINASE INHIBITORS FOR THE TREATMENT OF CANCER AND INFLAMMATION Lexicon Pharmaceuticals, Inc. (US) 2010-05-26 EP claimed
WO-2009021169-A2 (7H-PYRR0L0 [2, 3-D] PYRIMIDIN-4-YL) -PIPERAZINES AS KINASE INHIBITORS FOR THE TREATMENT OF CANCER AND INFLAMMATION LEXICON PHARMACEUTICALS, INC. (US) 2009-02-12 WO claimed
EP-1506160-B1 PRODUCTION PROCESS OF AMINOMETHYL GROUP-CONTAINING BENZAMIDE COMPOUND SHOWA DENKO KK (JP) 2008-08-13 EP claimed
WO-2008077651-A1 PYRIDO(3,2-D)PYRIMIDINES USEFUL FOR TREATING VIRAL INFECTIONS GILEAD SCIENCES, INC. (US) 2008-07-03 WO claimed
US-7227036-B2 Production process of aminomethyl group-containing benzamide compound SHOWA DENKO K.K. (JP) 2007-06-05 US claimed
US-7169759-B1 Tetrapeptide inhibitors of β-secretase ELAN PHARMACEUTICALS, INC. (US) 2007-01-30 US claimed
US-20060276496-A1 Anti-Cytokine Heterocyclic Compounds BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2006-12-07 US claimed
EP-1324991-B1 COMPOUNDS USEFUL IN THE TREATMENT OF INFLAMMATORY DISEASES GLAXO GROUP LTD (GB) 2006-11-15 EP claimed
CN-1839115-A Hydroxamic acid derivatives and preparation method thereof AMOREPACIFIC CORP (KR) 2006-09-27 CN claimed
US-20050203313-A1 Production process of aminomethyl group-containing benzamide compound SHOWA DENKO K.K. (JP) 2005-09-15 US claimed
EP-1192177-A1 STATINE-DERIVED TETRAPEPTIDE INHIBITORS OF BETA-SECRETASE Elan Pharmaceuticals, Inc. (US) 2002-04-03 EP claimed
WO-2000077030-A1 STATINE-DERIVED TETRAPEPTIDE INHIBITORS OF BETA-SECRETASE ELAN PHARMACEUTICALS, INC. (US) 2000-12-21 WO claimed

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

For each of this compound's patents that has machine-readable text (4 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-20050203313-A1 Production process of aminomethyl group-containing benzamide compound BCAT2, BCAT1, KCNH1 LOXL2 1988/4885F10 697/4885PLA2G10 4709/4885
US-20060276496-A1 Anti-Cytokine Heterocyclic Compounds MAPKAPK2, MAP4K2, MAP3K2 LOXL2 1783/4885F10 2911/4885PLA2G10 2264/4885
US-20100152190-A1 Substituted Pyrrolidine-2-Carboxamides ARG2, CCNY, PYCR1 LOXL2 3755/4885F10 1950/4885PLA2G10 4200/4885
US-20100190773-A1 Anti-Cytokine Heterocyclic Compounds MAPKAPK2, MAP4K2, MAP3K2 LOXL2 1783/4885F10 2911/4885PLA2G10 2264/4885

“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.