SCHEMBL2933985

SCHEMBL2933985

Cc1nn(-c2cccnc2)c2nc(-c3ccc(F)cc3)c(-c3ccncc3)c(-c3ccc(F)cc3)c12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.48
ALDH1A1 P00352 1/20 0.48
MAPT P10636 1/20 0.48
HPGD P15428 1/20 0.48
TSHR P16473 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
HSD17B10 Q99714 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
MAPK14 Q16539 11/20 0.47
SRC P12931 5/20 0.46
BRAF P15056 5/20 0.46
KDR P35968 5/20 0.46
CSNK1A1 P48729 1/20 0.45
CSNK1D P48730 1/20 0.45
CSNK1E P49674 1/20 0.45
EGFR P00533 1/20 0.44
RAF1 P04049 1/20 0.44
ADORA3 P0DMS8 1/20 0.44
ADORA2A P29274 1/20 0.44

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
SCHEMBL2931973 0.79 MAPK14 (0.53) MAPK14SRCBRAFKDRCSNK1A1
SCHEMBL2931830 0.71 MAPK14 (0.48) MAPK14CSNK1A1CSNK1DCSNK1ERAF1
SCHEMBL2926530 0.69 MAPK14 (0.52) MAPK14SRCBRAFKDRCSNK1A1
SCHEMBL2932183 0.68 MAPK14 (0.53) MAPK14SRCBRAFKDRCSNK1A1
SCHEMBL2929217 0.68 MAPK14 (0.50) MAPK14SRCBRAFKDRCSNK1A1
SCHEMBL4411198 0.67 MAPK14 (0.51) MAPK14SRCBRAFKDRCSNK1A1
SCHEMBL1384721 0.67 MAPK14 (0.48) KDM4EMAPK14SRCBRAFKDR
SCHEMBL2931965 0.66 MAPK14 (0.47) MAPK14BRAFCSNK1A1CSNK1DCSNK1E
SCHEMBL4417409 0.66 MAPK14 (0.46) MAPK14SRCBRAFKDRCSNK1A1
SCHEMBL2930745 0.66 MAPK14 (0.51) MAPK14CSNK1A1CSNK1DCSNK1EEGFR

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-1611131-B1 PYRAZOLOPYRIDINE DERIVATES PALAU PHARMA SA (ES) 2010-09-15 EP claimed