SCHEMBL8764951

SCHEMBL8764951

[O]c1ccnc(C(Cl)(Cl)Cl)c1

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.32
TSHR P16473 1/20 0.32
LOXL2 Q9Y4K0 2/20 0.31
SMARCA2 P51531 1/20 0.31
SMARCA4 P51532 1/20 0.31
LOX P28300 1/20 0.31
NOS3 P29474 1/20 0.30
NOS2 P35228 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
SCHEMBL2261695 0.79 LOXL2 (0.52) LOXL2SMARCA2SMARCA4LOXNOS3
SCHEMBL29006579 0.76 CYP3A4 (0.38) CYP3A4TSHRSMARCA2SMARCA4
SCHEMBL2259728 0.76 LOXL2 (0.36) LOXL2SMARCA2SMARCA4LOXNOS3
SCHEMBL8764955 0.74 SMARCA2 (0.33) CYP3A4TSHRLOXL2SMARCA2SMARCA4
Ethane SCHEMBL27705923 0.71 LMNA (0.32) SMARCA2SMARCA4
SCHEMBL451566 0.70
SCHEMBL3947643 0.70 RECQL (0.57) CYP3A4LOXL2LOX
SCHEMBL11523071 0.70 SMARCA2 (0.41) CYP3A4LOXL2SMARCA2SMARCA4LOX
SCHEMBL11327112 0.70 CCR1 (0.55) NOS3NOS2
SCHEMBL4017517 0.67 LOXL2 (0.41) LOXL2LOX

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
EP-0778267-A1 SULFONAMIDE DERIVATIVES AND INSECTICIDE, MITICIDE AND NEMATICIDE CONTAINING THE SAME OTSUKA KAGAKU KABUSHIKI KAISHA (JP) 1997-06-11 EP disclosed