SCHEMBL1387246

SCHEMBL1387246

NC(=O)c1cccc(OCc2ccccc2)c1

nearest known ligand 0.77

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 5/20 0.77
MAOB P27338 1/20 0.72
PARP10 Q53GL7 1/20 0.69
SMPD1 P17405 1/20 0.68
SRD5A2 P31213 1/20 0.67
PTPN1 P18031 1/20 0.65
F2 P00734 4/20 0.62
MEN1 O00255 1/20 0.61
KMT2A Q03164 1/20 0.61
SPHK2 Q9NRA0 1/20 0.59
NR1H4 Q96RI1 1/20 0.59
F10 P00742 1/20 0.59
MRGPRX4 Q96LA9 1/20 0.58

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 SCHEMBL27603151 0.98 NR4A2 (0.74) NR4A2MAOBPARP10SMPD1SRD5A2
SCHEMBL19980221 0.90 F10 (0.72) NR4A2MAOBPARP10PTPN1F2
SCHEMBL7451063 0.89 NR4A2 (0.70) NR4A2MAOBPARP10SMPD1SRD5A2
SCHEMBL7444275 0.88 NR4A2 (0.60) NR4A2MAOBPARP10SMPD1SRD5A2
SCHEMBL7442228 0.88 F2 (0.63) NR4A2MAOBPARP10SMPD1F2
SCHEMBL202497 0.88 F2 (0.61) NR4A2MAOBPARP10F2
SCHEMBL30207018 0.87 NR4A2 (1.00) NR4A2MAOBSMPD1SRD5A2PTPN1
SCHEMBL2666406 0.87 MEN1 (0.75) NR4A2MAOBPARP10SMPD1SRD5A2
SCHEMBL339009 0.87 NR4A2 (1.00) NR4A2MAOBSMPD1SRD5A2PTPN1
SCHEMBL7908051 0.87 SRD5A2 (0.85) NR4A2MAOBSMPD1SRD5A2PTPN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3037412-B1 INDOLE AMIDE COMPOUND AS INHIBITOR OF NECROSIS LG CHEMICAL LTD (KR) 2020-09-30 EP claimed
EP-1773768-B1 PYRROLE DERIVATIVES AS PHARMACEUTICAL AGENTS EXELIXIS INC (US) 2018-08-22 EP claimed
US-9868731-B2 Indole amide compound as inhibitor of necrosis LG CHEM, LTD. (KR) 2018-01-16 US claimed
US-20160194313-A1 INDOLE AMIDE COMPOUND AS INHIBITOR OF NECROSIS LG LIFE SCIENCES LTD. (KR) 2016-07-07 US claimed
EP-3037412-A1 INDOLE AMIDE COMPOUND AS INHIBITOR OF NECROSIS LG Life Sciences Ltd. (KR) 2016-06-29 EP claimed
US-20100222330-A1 New Compounds BIOVITRUM AB (SE) 2010-09-02 US claimed
US-7572787-B2 Substituted naphthalene sulfonamides BIOVITRUM AB (SE) 2009-08-11 US claimed
EP-1773768-A4 PYRROLE DERIVATIVES AS PHARMACEUTICAL AGENTS EXELIXIS INC (US) 2008-08-06 EP claimed
EP-1773768-A2 PYRROLE DERIVATIVES AS PHARMACEUTICAL AGENTS Exelixis, Inc. (US) 2007-04-18 EP claimed
US-20070066600-A1 Compounds PROXIMAGEN NEUROSCIENCE PLC (GB) 2007-03-22 US claimed
WO-2003013517-A1 AMINOISOXAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITORS PHARMACIA ITALIA S.P.A. (IT) 2003-02-20 WO claimed
WO-2002100822-A1 SUBSTITUTED SULFONAMIDE COMPOUNDS, PROCESS FOR THEIR USE AS MEDICAMENT FOR THE TREATMENT OF CNS DISORDERS, OBESITY AND TYPE II DIABETES BIOVITRUM AB (SE) 2002-12-19 WO claimed
WO-2002028353-A2 PHOSPHATE TRANSPORT INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2002-04-11 WO claimed
CN-1081624-C Benzamide analogs, useful as PARP (ADP-ribosyltransferase, ADRPT) DNA repair enzyme inhibitors NEWCASTLE UNIV VENTURE INVEST (GB) 2002-03-27 CN claimed
EP-0749415-B1 BENZAMIDE ANALOGS, USEFUL AS PARP (ADP-RIBOSYLTRANSFERASE, ADPRT) DNA REPAIR ENZYME INHIBITORS UNIV NEWCASTLE VENTURES LTD (GB) 1999-09-08 EP claimed
US-5756510-A POTENTIATE EFFECTS OF CYTOTOXIC DRUGS OR RADIOTHERAPY NEWCASTLE UNIVERSITY VENTURES LIMITED (GB) 1998-05-26 US claimed
JP-H09510704-A 1997-10-28 JP claimed
CN-1143358-A Benzamide analogs, useful as parp (ADP-ribosyltransferase, ADRPT) DNA repair enzyme inhibitors UNIV NEWCASTLE VENTURES LTD (GB) 1997-02-19 CN claimed
EP-0749415-A1 BENZAMIDE ANALOGS, USEFUL AS PARP (ADP-RIBOSYLTRANSFERASE, ADPRT) DNA REPAIR ENZYME INHIBITORS NEWCASTLE UNIVERSITY VENTURES LIMITED (GB) 1996-12-27 EP claimed
WO-1995024379-A1 BENZAMIDE ANALOGS, USEFUL AS PARP (ADP-RIBOSYLTRANSFERASE, ADPRT) DNA REPAIR ENZYME INHIBITORS NEWCASTLE UNIVERSITY VENTURES LIMITED (GB) 1995-09-14 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 (3 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-20160194313-A1 INDOLE AMIDE COMPOUND AS INHIBITOR OF NECROSIS IDO1, IDO2, TNF NR4A2 2730/4885MAOB 162/4885PARP10 2576/4885
US-20070066600-A1 Compounds SULT2A1, STS, SLC5A2 NR4A2 1841/4885MAOB 1020/4885PARP10 4650/4885
US-20100222330-A1 New Compounds SULT2A1, GPR119, STS NR4A2 1528/4885MAOB 1634/4885PARP10 4544/4885

“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.