SCHEMBL8765679

SCHEMBL8765679

Oc1cncc(C(Cl)(Cl)Cl)c1

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
APLNR P35414 1/20 0.38
HSD17B1 P14061 1/20 0.34
CYP11B1 P15538 2/20 0.33
CYP11B2 P19099 2/20 0.33
CYP17A1 P05093 1/20 0.33
CYP3A4 P08684 1/20 0.33
GABRA1 P14867 1/20 0.32
GABRB2 P47870 1/20 0.32
KDM4E B2RXH2 3/20 0.32
POLB P06746 1/20 0.32
GAA P10253 1/20 0.32
HSD17B10 Q99714 1/20 0.30
TSHR P16473 1/20 0.30
ATM Q13315 1/20 0.30
CHRNB2 P17787 1/20 0.30
CHRNA4 P43681 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
SCHEMBL5720493 0.82 TSHR (0.36) TSHR
SCHEMBL13885073 0.77 APLNR (0.35) APLNRHSD17B1GABRA1GABRB2KDM4E
SCHEMBL875313 0.76 TAS2R14 (0.38) APLNRCYP11B1CYP11B2CYP3A4
SCHEMBL8170002 0.76 GABRA1 (0.54) APLNRHSD17B1CYP11B1CYP11B2CYP3A4
SCHEMBL9255050 0.73 HCAR2 (0.40) TSHRCHRNB2CHRNA4
SCHEMBL27314463 0.73 GABRA1 (0.39) APLNRHSD17B1CYP11B1CYP11B2CYP3A4
SCHEMBL27314830 0.73 GABRA1 (0.39) APLNRHSD17B1CYP11B1CYP11B2CYP3A4
SCHEMBL3819587 0.73
SCHEMBL28705022 0.71 KDM4E (0.39) KDM4ETSHR
SCHEMBL29396834 0.71 KDM4E (0.39) KDM4ETSHR

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