SCHEMBL77931

SCHEMBL77931

NC(=O)c1ccc(Cl)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP4K4 O95819 4/20 0.62
CES2 O00748 2/20 0.62
CES1 P23141 2/20 0.62
TSHR P16473 2/20 0.59
ALOX15 P16050 1/20 0.59
CA1 P00915 2/20 0.56
CA2 P00918 2/20 0.56
L3MBTL1 Q9Y468 3/20 0.56
MAPT P10636 2/20 0.56
ALDH1A1 P00352 2/20 0.56
LMNA P02545 2/20 0.56
KDM4E B2RXH2 1/20 0.56
PARP1 P09874 2/20 0.55
POLB P06746 1/20 0.55
CYP3A4 P08684 1/20 0.55
CYP2C19 P33261 1/20 0.55
RECQL P46063 1/20 0.55
BLM P54132 1/20 0.55
PMP22 Q01453 1/20 0.55
HSD17B10 Q99714 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
SCHEMBL29959902 1.00 MAP4K4 (0.62) MAP4K4CES2CES1TSHRALOX15
Hydrochloric Acid SCHEMBL3772040 0.97 MAP4K4 (0.60) MAP4K4CES2CES1TSHRALOX15
Hydrochloric Acid SCHEMBL409480 0.97 MAP4K4 (0.60) MAP4K4CES2CES1TSHRALOX15
Hydrochloric Acid SCHEMBL28021646 0.97 MAP4K4 (0.60) MAP4K4CES2CES1TSHRALOX15
Iodide SCHEMBL19056893 0.97 MAP4K4 (0.60) MAP4K4CES2CES1TSHRALOX15
Bromide SCHEMBL28799121 0.97 MAP4K4 (0.60) MAP4K4CES2CES1TSHRALOX15
Nitrogen SCHEMBL27780715 0.95 MAP4K4 (0.58) MAP4K4CES2CES1TSHRALOX15
SCHEMBL2689662 0.93 MAP4K4 (0.72) MAP4K4CES2CES1TSHRALOX15
Benzamide SCHEMBL9812910 0.91 PARP1 (0.73) MAP4K4CES2CES1TSHRALOX15
4-Chloroaniline SCHEMBL11600778 0.91 PARP10 (0.61) MAP4K4CES2CES1TSHRALOX15

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

Appears in 4177 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4743438-A1 AN IMPROVED PROCESS FOR THE PREPARATION OF BENZONITRILE COMPOUNDS FROM THE BENZOTRICHLORIDE COMPOUNDS Aarti Industries Limited (IN) 2026-05-20 EP claimed
EP-4665705-A1 A PROCESSES FOR THE PREPARATION OF BENZONITRILE COMPOUNDS FROM THE CORRESPONDING BENZOTRICHLORIDE COMPOUNDS Aarti Industries Limited (IN) 2025-12-24 EP claimed
EP-3719018-B1 PURINE AND DEAZAPURINE DERIVATIVES AS PHARMACEUTICAL COMPOUNDS ASTEX THERAPEUTICS LTD (GB) 2025-08-27 EP claimed
CN-120004697-A Preparation method of OrgVO material and application of OrgVO material as secondary battery anode material 同济大学 2025-05-16 CN claimed
CN-119875232-A Flame-retardant cable and preparation method thereof 佰汇电缆有限公司 2025-04-25 CN claimed
WO-2025068995-A1 AN IMPROVED PROCESS FOR THE PREPARATION OF BENZONITRILE COMPOUNDS FROM THE BENZOTRICHLORIDE COMPOUNDS AARTI INDUSTRIES LIMITED (IN) 2025-04-03 WO claimed
CN-119502501-A High-barrier anti-leakage packaging bag for medical instrument storage and preparation method 江苏帕科医疗股份有限公司 2025-02-25 CN claimed
CN-119504475-A N-alkylamine compound, preparation method and application 南阳师范学院 2025-02-25 CN claimed
CN-119371298-A Method for efficiently synthesizing indenone compound 南阳师范学院 2025-01-28 CN claimed
WO-2024171098-A1 A PROCESSES FOR THE PREPARATION OF BENZONITRILE COMPOUNDS FROM THE CORRESPONDING BENZOTRICHLORIDE COMPOUNDS AARTI INDUSTRIES LIMITED (IN) 2024-08-22 WO claimed
EP-0105080-A2 A method for alkoxylation VISTA CHEMICAL COMPANY (US) 1984-04-11 EP claimed
EP-0104309-A2 Catalysts for alkoxylation reactions VISTA CHEMICAL COMPANY (US) 1984-04-04 EP claimed
US-4376868-A Alkoxylation of cresylic acids CONOCO INC. (US) 1983-03-15 US claimed
EP-0049358-A1 Strontium and barium containing alkoxylation systems for unsaturated alcohols Conoco Phillips Company (US) 1982-04-14 EP claimed
EP-0046947-A1 Strontium and barium containing alkoxylation systems Conoco Phillips Company (US) 1982-03-10 EP claimed
US-4225706-A Polychalcogen ester of cephem compound, process for preparing the same and method for removing the protective group of the same MEIJI SEIKA KAISHA LTD. (JP) 1980-09-30 US claimed
EP-0003663-A2 Amino-substituted phenyl and heteroaryl compounds, process for their preparation and pharmaceutical compositions containing them AMERICAN CYANAMID COMPANY (US) 1979-08-22 EP claimed
US-4159265-A Phenylazopyrazolo dyestuffs including disulfimide substituent BAYER AKTIENGESELLSCHAFT (DE) 1979-06-26 US claimed
US-4014892-A ANTHELMINTICS AMERICAN CYANAMID COMPANY (US) 1977-03-29 US claimed
US-3987026-A POLYESTERS CIBA-GEIGY CORPORATION (US) 1976-10-19 US claimed