Benzene

Benzene

SCHEMBL11904791

OP(O)O.OP(O)O.c1ccccc1

nearest known ligand 0.43

Full drug profile on Sugi Atlas →

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.43
TSHR P16473 1/20 0.43
IDO1 P14902 1/20 0.31

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 SCHEMBL18274779 1.00 TP53 (0.43) TP53TSHRIDO1
Benzene SCHEMBL28732344 1.00 TP53 (0.43) TP53TSHRIDO1
Benzene SCHEMBL5665687 1.00 TP53 (0.43) TP53TSHRIDO1
Benzene SCHEMBL29418269 1.00 TP53 (0.43) TP53TSHRIDO1
Benzene SCHEMBL9099545 0.94 TP53 (0.38) TP53TSHR
Hydrogen Peroxide SCHEMBL2884537 0.84
SCHEMBL6337 0.76
Benzene SCHEMBL6889012 0.76 TSHR (0.75) TP53TSHR
SCHEMBL8442506 0.76
Benzene SCHEMBL3366795 0.76 TP53 (0.33) TP53TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105733158-A Novel plastic filled masterbatch 上海宏盎实业发展有限公司 2016-07-06 CN disclosed
EP-2313421-B1 LIQUID OXYALKYLENE BRIDGED BIS- AND TRIS-PHOSPHITE ESTER MIXTURES BASF SE (DE) 2012-08-15 EP disclosed
CN-1062576-C polypropylene composition and uses thereof MITSUT PETROCHEMICAL IND LTD (JP) 2001-02-28 CN disclosed
CN-1139130-A Polypropylene composition and uses thereof MITSUT PETROCHEMICAL IND LTD (JP) 1997-01-01 CN disclosed