SCHEMBL2531295

SCHEMBL2531295

NC(=O)c1cccc(Oc2ccccc2)c1

nearest known ligand 0.83

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PARP10 Q53GL7 7/20 0.83
▸ PARP14 Q460N5 4/20 0.83
▸ PARP15 Q460N3 3/20 0.83
▸ TNKS O95271 1/20 0.83
▸ TNKS2 Q9H2K2 1/20 0.83
▸ PARP2 Q9UGN5 1/20 0.83
▸ AKR1C3 P42330 1/20 0.72
▸ PARP1 P09874 2/20 0.65
▸ HDAC8 Q9BY41 1/20 0.64
▸ ERCC5 P28715 1/20 0.58
▸ FEN1 P39748 1/20 0.58
▸ F2 P00734 1/20 0.58
▸ F10 P00742 1/20 0.58
▸ KMT2A Q03164 3/20 0.57
▸ MAPT P10636 2/20 0.57
▸ MEN1 O00255 2/20 0.57
▸ POLB P06746 1/20 0.56
▸ CYP3A4 P08684 1/20 0.56
▸ TSHR P16473 1/20 0.56
▸ CYP2C19 P33261 1/20 0.56

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
SCHEMBL30434552 1.00 PARP10 (0.83) PARP10PARP14PARP15TNKSTNKS2
Hydrochloric Acid SCHEMBL28772951 0.98 PARP10 (0.80) PARP10PARP14PARP15TNKSTNKS2
Methyl Alcohol SCHEMBL8784315 0.96 PARP10 (0.77) PARP10PARP14PARP15TNKSTNKS2
Formic Acid SCHEMBL30728616 0.93 PARP10 (0.73) PARP10PARP14PARP15TNKSTNKS2
SCHEMBL6631040 0.91 PARP10 (1.00) PARP10PARP14PARP15TNKSTNKS2
Diphenylether SCHEMBL3013964 0.88 PARP10 (0.88) PARP10PARP14PARP15TNKSTNKS2
SCHEMBL618677 0.87 PARP10 (0.81) PARP10PARP14PARP15TNKSTNKS2
SCHEMBL1718819 0.86 PARP10 (0.71) PARP10PARP14PARP15TNKSTNKS2
SCHEMBL27320423 0.86 PARP10 (0.73) PARP10PARP14PARP15TNKSTNKS2
SCHEMBL3650722 0.86 PARP10 (0.78) PARP10PARP14PARP15TNKSTNKS2

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 380 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
CN-105658625-B Indole amide compounds as inhibitors of cellular necrosis 株式会社LG化学 2019-05-03 — — CN claimed
EP-1773768-B1 PYRROLE DERIVATIVES AS PHARMACEUTICAL AGENTS EXELIXIS INC (US) 2018-08-22 — — EP claimed
EP-2855699-B1 PROMOTERS AND TERMINATORS FOR USE IN EUKARYOTIC CELLS EXXONMOBIL RES & ENG CO (US) 2018-07-18 — — 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-20140316107-A1 CYCLIN BASED INHIBITORS OF CDK2 AND CDK4 UNIVERSITY OF SOUTH CAROLINA 2014-10-23 — — US claimed
EP-2074089-B1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2013-09-18 — — EP claimed
US-8222248-B2 Organic compounds NOVARTIS AG (CH) 2012-07-17 — — US claimed
WO-2003053361-A2 PYRROLOPYRIMIDINE A2b SELECTIVE ANTAGONIST COMPOUNDS, THEIR SYNTHESIS AND USE OSI PHARMACEUTICALS, INC. (US) 2003-07-03 — — WO claimed
EP-1301527-A2 PEPTIDES AS NS3-SERINE PROTEASE INHIBITORS OF HEPATITIS C VIRUS CORVAS INTERNATIONAL, INC. (US) 2003-04-16 — — EP 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
US-20020068702-A1 Novel peptides as NS3-serine protease inhibitors of hepatitis C virus DENDREON PHARMACEUTICALS, INC. 2002-06-06 — — US claimed
WO-2002008251-A2 PEPTIDES AS NS3-SERINE PROTEASE INHIBITORS OF HEPATITIS C VIRUS CORVAS INTERNATIONAL, INC. (US) 2002-01-31 — — WO claimed
CN-1310621-A Substituted anilide compounds and methods SMITHKLINE BEECHAM CORP (US) 2001-08-29 — — CN claimed
US-4435332-A POSTEMERGENCE, PREEMERGENCE HERBICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1984-03-06 — — US claimed
US-4263039-A HERBICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1981-04-21 — — US claimed
US-4173464-A HERBICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1979-11-06 — — US 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-20020068702-A1 Novel peptides as NS3-serine protease inhibitors of hepatitis C virus VIP, TMPRSS15, TMPRSS11D PARP10 1690/4885PARP14 2027/4885PARP15 1586/4885
US-20140316107-A1 CYCLIN BASED INHIBITORS OF CDK2 AND CDK4 CDK4, CDK2, CDK2AP2 PARP10 1791/4885PARP14 1604/4885PARP15 1961/4885
US-20160194313-A1 INDOLE AMIDE COMPOUND AS INHIBITOR OF NECROSIS IDO1, IDO2, TNF PARP10 2576/4885PARP14 3360/4885PARP15 1936/4885

“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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