Benzene

Benzene

SCHEMBL8002830

C=CC(F)(F)F.c1ccccc1

nearest known ligand 0.30

Full drug profile on Sugi Atlas →

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.30
TSHR P16473 2/20 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
SCHEMBL33041 0.87
Hydrogen Sulfide SCHEMBL5636795 0.82
SCHEMBL11096784 0.82
Fluoride SCHEMBL25175826 0.82
Fluoride SCHEMBL1501667 0.82
SCHEMBL15936382 0.78
Bicarbonate SCHEMBL319318 0.77 LMNA (0.41) ALDH1A1TSHR
SCHEMBL3822662 0.77
Bicarbonate SCHEMBL25436122 0.77 LMNA (0.41) ALDH1A1TSHR
Bicarbonate SCHEMBL6436190 0.74 LMNA (0.39) ALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6124070-A STABILITY UNDER HIGH HUMIDITY AND AT LOW TEMPERATURE-LOW HUMIDITY, FINE PARTICLE SIZE AND A SHARP PARTICLE DIAMETER DISTRIBUTION; COMPRISING A BINDER RESIN, A COLORANT, A METHANOL-SOLUBLE RESIN HAVING ORGANIC ACID GROUPS CANON KABUSHIKI KAISHA (JP) 2000-09-26 US disclosed