SCHEMBL5228330

SCHEMBL5228330

CSc1ncc2c(n1)NC(=O)N(c1ccccc1C)C2

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DDB1 Q16531 1/20 0.43
CRBN Q96SW2 1/20 0.43
MAPK14 Q16539 1/20 0.42
FGFR4 P22455 2/20 0.39
KDR P35968 3/20 0.39
AURKA O14965 2/20 0.39
AURKB Q96GD4 2/20 0.39
NPC1 O15118 1/20 0.37
OPRM1 P35372 1/20 0.35
OPRL1 P41146 1/20 0.35
MAPT P10636 1/20 0.35
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
HTR1A P08908 1/20 0.34
DRD2 P14416 1/20 0.34
HTR2A P28223 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
ALDH1A1 P00352 1/20 0.34
HPGD P15428 1/20 0.34
RXFP1 Q9HBX9 1/20 0.34

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
SCHEMBL5230273 0.87 MAPK14 (0.56) MAPK14FGFR4KDRAURKAAURKB
SCHEMBL3139200 0.80 MEN1 (0.37) FGFR4MAPTMEN1KMT2ASMN1; SMN2
SCHEMBL6618748 0.80 MAPK14 (0.44) MAPK14FGFR4KDRAURKAAURKB
SCHEMBL6620382 0.79 FGFR4 (0.61) FGFR4KDRNPC1
SCHEMBL22165680 0.76 FGFR4 (0.53) FGFR4KDRAURKAAURKBNPC1
SCHEMBL3971040 0.76 FGFR4 (0.64) FGFR4KDRAURKAAURKBMAPT
SCHEMBL22179316 0.76 FGFR4 (0.40) CRBNFGFR4MAPTMEN1KMT2A
SCHEMBL5236612 0.74 GFER (0.44) DDB1CRBNMAPK14NPC1MAPT
SCHEMBL5233582 0.73 MAPK14 (0.79) MAPK14FGFR4
SCHEMBL5233575 0.73 MAPK14 (0.79) MAPK14FGFR4

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-1228070-B1 HETEROALKYLAMINO-SUBSTITUTED BICYCLIC NITROGEN HETEROCYCLES AS INHIBITORS OF P38 PROTEIN KINASE HOFFMANN LA ROCHE (CH) 2007-02-07 EP disclosed
US-6451804-B1 Heteroalkylamino-substituted bicyclic nitrogen heterocycles SYNTEX (U.S.A.) LLC 2002-09-17 US disclosed