SCHEMBL4417149

SCHEMBL4417149

CN(C)CC(C)(C)CNC(=O)Oc1nc2nc(Nc3ccc(F)cc3)ncc2cc1-c1ccccc1Br

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 4/20 0.39
CDK2 P24941 7/20 0.36
CDK9 P50750 6/20 0.36
CCNT1 O60563 5/20 0.36
CCNE1 P24864 3/20 0.36
PTK2 Q05397 2/20 0.35
FGFR2 P21802 1/20 0.34
FGFR4 P22455 1/20 0.34
FGFR3 P22607 1/20 0.34
CCNA2 P20248 2/20 0.33
MAPK10 P53779 2/20 0.33
IGF1R P08069 1/20 0.33
CCNA1 P78396 1/20 0.33
KCNA5 P22460 1/20 0.33
ABL1 P00519 1/20 0.33
EGFR P00533 1/20 0.33
PDGFRB P09619 1/20 0.33
KIT P10721 1/20 0.33
SRC P12931 1/20 0.33
PDGFRA P16234 1/20 0.33

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
SCHEMBL4418433 0.88 CDK2 (0.47) CDK2CDK9CCNT1CCNE1PTK2
SCHEMBL4410855 0.86 CCNT1 (0.42) FGFR1CDK2CDK9CCNT1CCNE1
SCHEMBL4411782 0.85 CDK2 (0.37) FGFR1CDK2CDK9CCNT1CCNE1
SCHEMBL4415084 0.84 MAPK10 (0.36) FGFR1CDK2CDK9CCNT1CCNE1
SCHEMBL4412920 0.84 MAPK10 (0.36) FGFR1CDK2CDK9CCNT1CCNE1
SCHEMBL4413555 0.84 BRAF (0.38) FGFR1CDK2CDK9CCNT1CCNE1
SCHEMBL4416330 0.84 CDK2 (0.45) FGFR1CDK2CDK9CCNT1CCNE1
SCHEMBL4416830 0.83 BRAF (0.44) CDK2CDK9CCNT1CCNE1
SCHEMBL4417977 0.83 MAPK1 (0.39) FGFR1CDK2CDK9CCNT1CCNE1
SCHEMBL4410707 0.83 TBK1 (0.38) FGFR1CDK2CDK9CCNT1CCNE1

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-1615921-B1 PYRIDO 2,3-D PYRIMIDIN-7-CARBOXYLIC ACID DERIVATIVES, THEIR MANUFACTURE AND USE AS PHARMACEUTICAL AGENTS HOFFMANN LA ROCHE (CH) 2009-03-18 EP claimed