SCHEMBL8764956

SCHEMBL8764956

[O]c1cc(C(Cl)(Cl)Cl)ccn1

nearest known ligand 0.38

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.38
NOS3 P29474 1/20 0.38
NOS2 P35228 1/20 0.38

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
SCHEMBL7822757 0.77 NOS3 (0.63) NOS3NOS2
SCHEMBL9474492 0.77 NOS3 (0.63) TSHRNOS3NOS2
SCHEMBL6280836 0.74 RECQL (0.48) TSHRNOS3NOS2
SCHEMBL7693999 0.73 LOXL2 (0.42) TSHRNOS3NOS2
SCHEMBL8764962 0.73 TSHR (0.38) TSHRNOS3NOS2
SCHEMBL11816122 0.70 GABRA1 (0.34) TSHR
SCHEMBL11325805 0.68 LOX (0.47) TSHRNOS3NOS2
SCHEMBL9474996 0.66 RECQL (0.37)
SCHEMBL8765696 0.65 TSHR (0.35) TSHR
SCHEMBL8764951 0.65 CYP3A4 (0.32) TSHRNOS3NOS2

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