SCHEMBL2820531

SCHEMBL2820531

Cc1nc2ccc(F)c(F)c2c(OC(=O)OCCC2CC2)c1C

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 1/20 0.37
GRM1 Q13255 1/20 0.31
SCN9A Q15858 1/20 0.31
HTR7 P34969 1/20 0.31
MMP13 P45452 2/20 0.31
TSHR P16473 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
SCHEMBL5833107 0.89 OPRL1 (0.35) OPRL1GRM1
SCHEMBL2821980 0.85 RAB9A (0.35) MMP13TSHR
SCHEMBL2820325 0.84 TSHR (0.40) MMP13TSHR
SCHEMBL2819833 0.82 NMT2 (0.32) MMP13TSHR
SCHEMBL2820341 0.82 MMP13 (0.31) MMP13TSHR
SCHEMBL2822989 0.81 MMP13 (0.31) MMP13TSHR
SCHEMBL2823212 0.81 SCN9A (0.34) SCN9AHTR7TSHR
SCHEMBL2823027 0.80 MMP13 (0.32) MMP13TSHR
SCHEMBL2821657 0.80 KDM4E (0.38) MMP13TSHR
SCHEMBL2820048 0.79 MMP13 (0.37) MMP13TSHR

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
EP-1386914-B1 HALOGENATED QUINOLINE DERIVATIVES AND ECTOPARASITE CONTROLLERS MEIJI SEIKA KAISHA (JP) 2010-10-27 EP disclosed
US-7022855-B2 Halogen-substituted quinoline derivatives and ectoparasite control agent MEIJI SEIKA KAISHA, LTD. (JP) 2006-04-04 US disclosed