Benzene

Benzene

SCHEMBL27271103

NC(=O)c1nccs1.c1ccccc1

nearest known ligand 0.57

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.57
RBBP9 O75884 5/20 0.47
PLA2G4A P47712 1/20 0.46
CES1 P23141 1/20 0.45
KMT2A Q03164 2/20 0.41
TSHR P16473 1/20 0.41
NOS1 P29475 1/20 0.41
HSD17B10 Q99714 1/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
CYP1A2 P05177 4/20 0.40
CASP3 P42574 3/20 0.40
SENP8 Q96LD8 3/20 0.40
SENP7 Q9BQF6 3/20 0.40
SENP6 Q9GZR1 3/20 0.40
CYP2D6 P10635 3/20 0.40
CYP2C19 P33261 3/20 0.40
BCAT2 O15382 1/20 0.40
PLA2G7 Q13093 1/20 0.40
AURKA O14965 1/20 0.40

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
SCHEMBL158422 0.96
Potassium SCHEMBL31461086 0.93
Hydrochloric Acid SCHEMBL27718659 0.93
SCHEMBL31461088 0.93
Ammonia Solution, Strong SCHEMBL28224778 0.93
Hydrochloric Acid SCHEMBL5013504 0.93 ALDH1A1 (0.59) ALDH1A1RBBP9PLA2G4ACES1KMT2A
SCHEMBL31461084 0.93
Pyridine SCHEMBL5311951 0.92 ALDH1A1 (0.50) ALDH1A1RBBP9PLA2G4ACES1KMT2A
Ammonia Solution, Strong SCHEMBL28224779 0.91 ALDH1A1 (0.57) ALDH1A1RBBP9PLA2G4ACES1KMT2A
SCHEMBL28029545 0.91 ALDH1A1 (0.57) ALDH1A1RBBP9PLA2G4ACES1KMT2A

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104610188-B Itrile group benzene thiazole carboxylic acid amides's compounds containing benzene carbon amidine structure, its preparation and purposes 佛山市赛维斯医药科技有限公司 2016-07-27 CN disclosed
CN-104610188-B Itrile group benzene thiazole carboxylic acid amides's compounds containing benzene carbon amidine structure, its preparation and purposes 佛山市赛维斯医药科技有限公司 2016-07-27 CN disclosed
CN-104610188-B Itrile group benzene thiazole carboxylic acid amides's compounds containing benzene carbon amidine structure, its preparation and purposes 佛山市赛维斯医药科技有限公司 2016-07-27 CN disclosed
CN-104628673-A Nitrile benzene thiazolecarboxamide type compound containing tert-butylamidine structure and application thereof FOSHAN SAIWEISI PHARMACEUTICAL TECHNOLOGY CO LTD 2015-05-20 CN disclosed
CN-104610188-A Nitrile benzene thiazolecarboxamide type compound containing phenyl amidine structure as well as preparation method and application thereof FOSHAN SAIWEISI PHARMACEUTICAL TECHNOLOGY CO LTD 2015-05-13 CN disclosed
CN-104592150-A Cyclopropyl amidine structure containing cyanobenzene thiazolecarboxylic acid amide compound and application thereof FOSHAN SAIWEISI PHARMACEUTICAL TECHNOLOGY CO LTD 2015-05-06 CN disclosed
CN-1021010-C SUBSTITUTED THIAZOLES COMPOSITION AND THEIR USE AS FUNGICIDES MONSANTO CO (US) 1993-06-02 CN disclosed
CN-1043127-A Substituted thiazole and mycocide purposes thereof MONSANTO CO (US) 1990-06-20 CN disclosed