SCHEMBL5583752

SCHEMBL5583752

COc1ccnc(C(=O)Nc2ccc(C(F)(F)F)cc2)c1O

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.57
TDO2 P48775 1/20 0.53
KDR P35968 2/20 0.48
EGLN1 Q9GZT9 1/20 0.47
TRPV1 Q8NER1 6/20 0.47
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
SORT1 Q99523 1/20 0.45
EPHX2 P34913 1/20 0.44
RAF1 P04049 1/20 0.44
CISD2 Q8N5K1 1/20 0.44
PTGS1 P23219 1/20 0.44

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
SCHEMBL14284572 0.94 TDO2 (0.54) MAPTTDO2KDRTRPV1RAB9A
SCHEMBL4701462 0.94 MAPT (0.52) MAPTTDO2KDRTRPV1RAB9A
SCHEMBL14284599 0.93 MAPT (0.51) MAPTTDO2KDREGLN1TRPV1
SCHEMBL14284603 0.89 MAPT (0.50) MAPTTDO2KDRNPC1RAB9A
SCHEMBL14284608 0.89 TDO2 (0.50) MAPTTDO2KDRTRPV1RAF1
SCHEMBL14284566 0.89 TDO2 (0.50) MAPTTDO2KDRTRPV1PTGS1
SCHEMBL14284604 0.89 EPHX2 (0.55) MAPTTDO2KDRNPC1RAB9A
SCHEMBL5583578 0.89 SMN1; SMN2 (0.53) MAPTKDRTRPV1NPC1RAB9A
SCHEMBL14284607 0.88 MAPT (0.55) MAPTTDO2KDRNPC1RAB9A
SCHEMBL14284606 0.87 MAPT (0.57) MAPTTDO2KDR

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
US-7183278-B1 Picolinamide derivative and harmful organism control agent comprising said picolinamide derivative as active component MEIJI SEIKA KAISHA, LTD. (JP) 2007-02-27 US disclosed
EP-1134214-A1 PICOLINAMIDE DERIVATIVES AND PEST CONTROLLERS CONTAINING THE SAME AS THE ACTIVE INGREDIENT MEIJI SEIKA KAISHA LTD. (JP) 2001-09-19 EP disclosed