SCHEMBL2820199

SCHEMBL2820199

C=COC(=O)Oc1c(C)c(C)nc2ccc(F)c(F)c12

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 2/20 0.31
TNKS O95271 1/20 0.31
PARP1 P09874 1/20 0.31
TNKS2 Q9H2K2 1/20 0.31

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
SCHEMBL2822987 0.86 KDM4E (0.32) MMP13TNKSPARP1TNKS2
SCHEMBL2821657 0.86 KDM4E (0.38) MMP13
SCHEMBL2820048 0.85 MMP13 (0.37) MMP13TNKSPARP1TNKS2
SCHEMBL2820325 0.82 TSHR (0.40) MMP13TNKSPARP1TNKS2
SCHEMBL2820985 0.82 MMP13 (0.34) MMP13TNKSPARP1TNKS2
SCHEMBL2823027 0.79 MMP13 (0.32) MMP13
SCHEMBL2819785 0.78 MMP13 (0.31) MMP13TNKSPARP1TNKS2
SCHEMBL2821739 0.78 TSHR (0.34) MMP13TNKSPARP1TNKS2
SCHEMBL2820529 0.77 ALDH1A1 (0.30)
SCHEMBL2821980 0.77 RAB9A (0.35) MMP13TNKSPARP1TNKS2

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