Benzene

Benzene

SCHEMBL192784

O=C1C2CC=CCC2C(=O)N1SC(Cl)(Cl)C(Cl)Cl.c1ccccc1.c1ccccc1

nearest known ligand 0.65

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.65
TP53 P04637 2/20 0.65
LMNA P02545 2/20 0.65
TSHR P16473 2/20 0.65
KMT2A Q03164 2/20 0.65
HSD17B10 Q99714 2/20 0.65
CYP3A4 P08684 1/20 0.65
HPGD P15428 1/20 0.65
ALOX15 P16050 1/20 0.65
MAPK1 P28482 1/20 0.65
HTT P42858 1/20 0.65
HIF1A Q16665 1/20 0.65
TDP1 Q9NUW8 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.36
CA12 O43570 2/20 0.33
CA1 P00915 2/20 0.33
CA2 P00918 2/20 0.33
CA9 Q16790 2/20 0.33
USP2 O75604 1/20 0.33
NPSR1 Q6W5P4 2/20 0.33

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
Benzene SCHEMBL5324108 1.00 ALDH1A1 (0.65) ALDH1A1TP53LMNATSHRKMT2A
SCHEMBL22931 0.97 ALDH1A1 (0.69) ALDH1A1TP53LMNATSHRKMT2A
SCHEMBL22930 0.97 ALDH1A1 (0.69) ALDH1A1TP53LMNATSHRKMT2A
SCHEMBL428344 0.95 ALDH1A1 (0.67) ALDH1A1TP53LMNATSHRKMT2A
SCHEMBL20873426 0.95 ALDH1A1 (0.67) ALDH1A1TP53LMNATSHRKMT2A
SCHEMBL20395717 0.95 ALDH1A1 (0.67) ALDH1A1TP53LMNATSHRKMT2A
SCHEMBL7029440 0.95 ALDH1A1 (0.67) ALDH1A1TP53LMNATSHRKMT2A
Methane SCHEMBL6007285 0.95 ALDH1A1 (0.67) ALDH1A1TP53LMNATSHRKMT2A
SCHEMBL7023136 0.95 ALDH1A1 (0.67) ALDH1A1TP53LMNATSHRKMT2A
Ammonia Solution, Strong SCHEMBL1006165 0.95 ALDH1A1 (0.67) ALDH1A1TP53LMNATSHRKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4144140-A Method for the preparation of additives in organo-aluminum electrolyte media SIEMENS AKTIENGESELLSCHAFT (DE) 1979-03-13 US claimed
US-4071526-A Method for the preparation of additives in organo-aluminum electrolyte media SIEMENS AKTIENGESELLSCHAFT (DT) 1978-01-31 US claimed
US-4062738-A NICKEL SULFATE AND CHLORIDE, BORIC ACID, SACCHARIN E. I. DU PONT DE NEMOURS AND COMPANY (US) 1977-12-13 US claimed
US-11739235-B2 Process for preparing liquid compositions of etherified melamine formaldehyde resins BASF SE (DE) 2023-08-29 US disclosed
EP-2804917-B1 LOW VOLATILE ORGANIC COMPOMEMT DRY ERASE SILOXANE-BASED COATINGS IDEAPAINT INC (US) 2020-09-02 EP disclosed
US-20200095453-A1 PROCESS FOR PREPARING LIQUID COMPOSITIONS OF ETHERIFIED MELAMINE FORMALDEHYDE RESINS BASF SE (DE) 2020-03-26 US disclosed
EP-3559066-A1 PROCESS FOR PREPARING LIQUID COMPOSITIONS OF ETHERIFIED MELAMINE FORMALDEHYDE RESINS BASF SE (DE) 2019-10-30 EP disclosed
WO-2018115060-A1 PROCESS FOR PREPARING LIQUID COMPOSITIONS OF ETHERIFIED MELAMINE FORMALDEHYDE RESINS BASF SE (DE) 2018-06-28 WO disclosed
EP-1608691-B1 CROSSLINKING COMPOSITION ALLNEX IP SARL (LU) 2018-04-11 EP disclosed
EP-2681222-B1 PROCESS FOR PREPARATION OF KETOLIDE INTERMEDIATES WOCKHARDT LTD (IN) 2018-02-28 EP disclosed
US-9493675-B2 Clear siloxane-based write-erase coating with low volatile organic character IDEAPAINT, INC. (US) 2016-11-15 US disclosed
EP-0025694-A1 Bright nickel plating bath and process and composition therefor M & T CHEMICALS, INC. (US) 1981-03-25 EP disclosed
US-4183789-A PRECIPITATION OF CALCIUM OXALATE M&T CHEMICALS INC. (US) 1980-01-15 US disclosed
US-4101388-A RARE EARTH COMPOUNDS M & T CHEMICALS INC. (US) 1978-07-18 US disclosed
US-4069112-A UNSATURATED CYCLOSULFONE M & T CHEMICALS INC. (US) 1978-01-17 US disclosed
US-4053373-A ELECTROPLATING OF NICKEL, COBALT, NICKEL-COBALT, NICKEL-IRON, COBALT-IRON AND NICKEL-IRON-COBALT DEPOSITS M & T CHEMICALS INC. (US) 1977-10-11 US disclosed
US-4046647-A BETA-SUBSTITUTED, GAMMA-SUBSTITUTED, OR BETA, GAMMA-DISUBSTITUTED SULFONE M&T CHEMICALS INC. (US) 1977-09-06 US disclosed
US-4036709-A ORGANIC DISULFIDE M & T CHEMICALS INC. (US) 1977-07-19 US disclosed
US-4014759-A ASCORBIC, ISOASCORBIC OR ERYTHORBIC ACID, REACTION PRODUCT OF AROMATIC SULFINATE AND ALDEHYDE M & T CHEMICALS INC. (US) 1977-03-29 US disclosed
US-3969399-A CALCIUM 1-HYDROXY-3-(SODIUM SULFONATO)-BUTANESULFONATE M & T CHEMICALS INC. (US) 1976-07-13 US disclosed