SCHEMBL3793485

SCHEMBL3793485

N#Cc1[nH]c(-c2c(F)cccc2Cl)nc1-c1ccc(N)nc1

nearest known ligand 0.50

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PTGES O14684 17/20 0.50
JAK2 O60674 1/20 0.42
CYP2C9 P11712 1/20 0.40
MAPK14 Q16539 1/20 0.39
NPBWR1 P48145 1/20 0.38
TYK2 P29597 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
SCHEMBL3792912 0.86 PTGES (0.45) PTGESJAK2CYP2C9MAPK14
SCHEMBL3798576 0.86 PTGES (0.48) PTGESJAK2CYP2C9MAPK14
SCHEMBL3797473 0.85 PTGES (0.48) PTGESJAK2CYP2C9MAPK14
SCHEMBL3791524 0.83 PTGES (0.49) PTGESJAK2CYP2C9MAPK14
SCHEMBL3793316 0.82 PTGES (0.76) PTGESJAK2CYP2C9MAPK14
SCHEMBL3792831 0.82 PTGES (0.45) PTGESJAK2CYP2C9MAPK14
SCHEMBL3798793 0.82 PTGES (0.45) PTGESJAK2MAPK14
SCHEMBL3795334 0.80 PTGES (0.43) PTGESJAK2CYP2C9MAPK14
SCHEMBL3794204 0.80 PTGES (0.48) PTGESJAK2CYP2C9MAPK14
SCHEMBL3798761 0.80 PTGES (0.48) PTGESJAK2CYP2C9MAPK14

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010127152-A2 COMPOUNDS AND COMPOSITIONS AS MICROSOMAL PROSTAGLANDIN E SYNTHASE-1 INHIBITORS IRM LLC (BM) 2010-11-04 WO disclosed