Benzene

Benzene

SCHEMBL11301583

CCCCCCCCCCCCc1ccccc1O.c1ccccc1

nearest known ligand 0.65

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BID P55957 3/20 0.65
MCL1 Q07820 3/20 0.65
KAT8 Q9H7Z6 3/20 0.65
BCL2L1 Q07817 2/20 0.65
BAK1 Q16611 2/20 0.65
SAE1 Q9UBE0 2/20 0.65
EP300 Q09472 2/20 0.65
KAT5 Q92993 2/20 0.65
PPARG P37231 1/20 0.65
PPARA Q07869 1/20 0.65
KAT2A Q92830 1/20 0.65
KAT2B Q92831 1/20 0.65
LIPG Q9Y5X9 1/20 0.61
MAPT P10636 2/20 0.59
ALOX15 P16050 2/20 0.59
TYR P14679 2/20 0.59
MEN1 O00255 1/20 0.59
TP53 P04637 1/20 0.59
CYP3A4 P08684 1/20 0.59
ALOX5 P09917 1/20 0.59

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 SCHEMBL28139859 1.00 BID (0.65) BIDMCL1KAT8BCL2L1BAK1
Benzene SCHEMBL27342472 1.00 BID (0.65) BIDMCL1KAT8BCL2L1BAK1
Benzene SCHEMBL27423149 1.00 BID (0.65) BIDMCL1KAT8BCL2L1BAK1
Benzene SCHEMBL28147291 0.98 BID (0.63) BIDMCL1KAT8BCL2L1BAK1
SCHEMBL273583 0.98 LIPG (0.63) BIDMCL1KAT8BCL2L1BAK1
SCHEMBL11205038 0.98 LIPG (0.63) BIDMCL1KAT8BCL2L1BAK1
SCHEMBL223052 0.98 LIPG (0.63) BIDMCL1KAT8BCL2L1BAK1
SCHEMBL9321974 0.98 LIPG (0.63) BIDMCL1KAT8BCL2L1BAK1
SCHEMBL7450807 0.98 LIPG (0.63) BIDMCL1KAT8BCL2L1BAK1
SCHEMBL2922317 0.98 LIPG (0.63) BIDMCL1KAT8BCL2L1BAK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106608956-B A kind of preparation method and application of alkyl phenol-phenol-formaldehyde resin 华奇(中国)化工有限公司 2018-11-09 CN disclosed
CN-106608956-A Preparation method and applications of alkyl phenol-phenol-formaldehyde resin 华奇(中国)化工有限公司 2017-05-03 CN disclosed
US-4247521-A Liquid-liquid contacting system UNION CARBIDE CORPORATION (US) 1981-01-27 US disclosed