SCHEMBL5583719

SCHEMBL5583719

COc1ccnc(C(=O)Nc2ccccc2)c1O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.53
RAB9A P51151 5/20 0.53
KMT2A Q03164 4/20 0.53
MEN1 O00255 3/20 0.53
ATR Q13535 3/20 0.52
IDO1 P14902 2/20 0.48
TDO2 P48775 2/20 0.48
ABCC1 P33527 1/20 0.47
CASP3 P42574 1/20 0.47
SENP7 Q9BQF6 1/20 0.47
DYRK3 O43781 1/20 0.46
MAP4K4 O95819 1/20 0.46
CDK1 P06493 1/20 0.46
CDK2 P24941 1/20 0.46
MARK3 P27448 1/20 0.46
CLK2 P49760 1/20 0.46
GSK3B P49841 1/20 0.46
CSNK2A1 P68400 1/20 0.46
CSNK1G2 P78368 1/20 0.46
CDK5 Q00535 1/20 0.46

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
SCHEMBL5583568 0.95 MEN1 (0.54) NPC1RAB9AKMT2AMEN1ATR
SCHEMBL2237038 0.90 RAB9A (0.53) NPC1RAB9AKMT2AMEN1ALDH1A1
SCHEMBL5583820 0.90 RAB9A (0.60) NPC1RAB9AKMT2AMEN1IDO1
SCHEMBL5583817 0.89 MAPT (0.56) NPC1RAB9AKMT2AMEN1ABCC1
SCHEMBL5583857 0.88 RAB9A (0.51) NPC1RAB9AKMT2AMEN1ALDH1A1
SCHEMBL5583684 0.87 KDM4E (0.55) NPC1RAB9AKMT2AMEN1TDO2
SCHEMBL5583770 0.87 GRM4 (0.52) NPC1RAB9AKMT2AMEN1CASP3
SCHEMBL5583750 0.87 SMN1; SMN2 (0.50) NPC1RAB9AKMT2AMEN1ALDH1A1
SCHEMBL5584055 0.87 ABCC1 (0.53) NPC1RAB9AKMT2AMEN1ATR
SCHEMBL5583672 0.86 SCN9A (0.54) NPC1RAB9AKMT2AMEN1ALDH1A1

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