Benzene

Benzene

SCHEMBL28098345

C=CC=CC(=O)C=C.c1ccccc1

nearest known ligand 0.39

Full drug profile on Sugi Atlas →

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GSR P00390 1/20 0.39
LMNA P02545 2/20 0.38
AKT1 P31749 1/20 0.36
TGM2 P21980 1/20 0.32
ALDH1A1 P00352 3/20 0.31
PLIN1 O60240 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2D6 P10635 1/20 0.31
MAPT P10636 1/20 0.31
CYP2C9 P11712 1/20 0.31
F3 P13726 1/20 0.31
RECQL P46063 1/20 0.31
PLIN5 Q00G26 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
ABHD5 Q8WTS1 1/20 0.31
THRB P10828 1/20 0.31
TSHR P16473 1/20 0.30
FGFR4 P22455 1/20 0.30

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 SCHEMBL28244330 0.97 GSR (0.38) GSRLMNAAKT1TGM2ALDH1A1
Bicarbonate SCHEMBL8017523 0.92 LMNA (0.40) GSRLMNAALDH1A1TSHRFGFR4
SCHEMBL12988473 0.92
SCHEMBL432679 0.92
SCHEMBL30481693 0.89
Water SCHEMBL12988165 0.89
Styrene SCHEMBL183213 0.84 ALDH1A1 (0.52) GSRLMNAAKT1TGM2ALDH1A1
Styrene SCHEMBL28353590 0.82 ALDH1A1 (0.50) GSRLMNAAKT1TGM2ALDH1A1
Methacrylic Acid SCHEMBL15443432 0.81 ALDH1A1 (0.36) LMNAALDH1A1TSHR
SCHEMBL9210711 0.80 LMNA (0.33) LMNAALDH1A1TSHRFGFR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108690267-A A kind of micro-foaming polypropylene material and preparation method thereof 芜湖创科新材料科技有限公司 2018-10-23 CN disclosed
CN-103183870-B A kind of Polyolefin/styrene resin composition and preparation method thereof 合肥杰事杰新材料股份有限公司 2016-09-07 CN disclosed