SCHEMBL5204360

SCHEMBL5204360

CCOC(=O)ON1CCN(C(=O)C(=O)c2cn(C)c3cc(OC)c(C(=O)N4CCC(Cc5ccc(F)cc5)CC4)cc23)CC1

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 8/20 0.50
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
TP53 P04637 1/20 0.39
MAPK1 P28482 1/20 0.39
KMT2A Q03164 1/20 0.39
HSD17B10 Q99714 1/20 0.39
OPRM1 P35372 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.37
GAA P10253 1/20 0.37

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
SCHEMBL5201330 0.92 MAPK14 (0.53) MAPK14CYP2C9CYP2C19KDM4EALDH1A1
SCHEMBL5202149 0.91 MAPK14 (0.51) MAPK14CYP2C9CYP2C19ALDH1A1
SCHEMBL5201020 0.89 MAPK14 (0.56) MAPK14CYP2C9CYP2C19ALDH1A1
SCHEMBL5205465 0.89 MAPK14 (0.50) MAPK14CYP2C9CYP2C19L3MBTL1
SCHEMBL5203602 0.88 MAPK14 (0.51) MAPK14CYP2C9CYP2C19KDM4EALDH1A1
SCHEMBL5202617 0.87 MAPK14 (0.56) MAPK14CYP2C9CYP2C19KDM4EALDH1A1
SCHEMBL5204726 0.86 MAPK14 (0.56) MAPK14CYP2C9CYP2C19ALDH1A1
SCHEMBL5203992 0.86 MAPK14 (0.56) MAPK14CYP2C9CYP2C19KDM4EALDH1A1
SCHEMBL5202103 0.85 MAPK14 (0.51) MAPK14CYP2C9CYP2C19KMT2AL3MBTL1
SCHEMBL5201216 0.85 MAPK14 (0.51) MAPK14CYP2C9CYP2C19ALDH1A1L3MBTL1

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
EP-1178983-B1 INDOLE-TYPE DERIVATIVES AS INHIBITORS OF P38 KINASE SCIOS INC (US) 2007-10-24 EP claimed