SCHEMBL5583786

SCHEMBL5583786

COc1ccnc(C(=O)Nc2ccc(Oc3ccc(C)cc3)cc2C(F)(F)F)c1O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.45
MAPK1 P28482 1/20 0.45
RAF1 P04049 7/20 0.44
KDR P35968 2/20 0.42
PDGFRA P16234 1/20 0.42
RAB9A P51151 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
NPC1 O15118 1/20 0.42
LMNA P02545 1/20 0.42
AHR P35869 1/20 0.42
BRAF P15056 3/20 0.40
NTSR1 P30989 1/20 0.39
MC4R P32245 1/20 0.39
PAX8 Q06710 1/20 0.39
AURKB Q96GD4 1/20 0.39
KDM4E B2RXH2 2/20 0.39
ALDH1A1 P00352 1/20 0.39
MAPK9 P45984 1/20 0.39
TP53 P04637 1/20 0.39
S1PR3 Q99500 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
SCHEMBL5583615 0.88 SMN1; SMN2 (0.55) MAPTKDRPDGFRARAB9ASMN1; SMN2
SCHEMBL5583640 0.87 SMN1; SMN2 (0.51) MAPTMAPK1KDRPDGFRARAB9A
SCHEMBL5583717 0.83 KDR (0.48) MAPTMAPK1RAF1KDRPDGFRA
SCHEMBL5583670 0.81 KDR (0.55) MAPK1KDRPDGFRARAB9ASMN1; SMN2
SCHEMBL14284570 0.80 PDGFRA (0.48) MAPTRAF1KDRPDGFRARAB9A
SCHEMBL5583728 0.79 KMT2A (0.56) MAPTKDRRAB9ASMN1; SMN2NPC1
SCHEMBL14284569 0.79 RAB9A (0.49) KDRPDGFRARAB9ASMN1; SMN2NPC1
SCHEMBL14284583 0.79 RAF1 (0.45) MAPTMAPK1RAF1KDRBRAF
SCHEMBL14284582 0.79 MAPT (0.48) MAPTMAPK1RAF1KDRSMN1; SMN2
SCHEMBL14284627 0.78 RAF1 (0.49) MAPK1RAF1KDRPDGFRABRAF

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