SCHEMBL7856079

SCHEMBL7856079

CN1C(=O)N(c2c(Cl)ccc(O)c2Cl)Cc2cnc(Nc3ccc(CCCC(=O)O)cc3)cc21

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
WEE1 P30291 7/20 0.40
EGFR P00533 3/20 0.40
FGFR1 P11362 3/20 0.40
SRC P12931 2/20 0.40
LCK P06239 1/20 0.36
MAPK14 Q16539 1/20 0.36
FGFR4 P22455 4/20 0.34
ERBB3 P21860 1/20 0.33
BRD4 O60885 1/20 0.32
P2RX3 P56373 2/20 0.32
EPHX2 P34913 1/20 0.32
FGFR2 P21802 1/20 0.31
FGFR3 P22607 1/20 0.31
KDR P35968 1/20 0.31
TNK2 Q07912 1/20 0.31
MAP4K2 Q12851 1/20 0.31

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
SCHEMBL3970398 0.85 LCK (0.51) WEE1EGFRFGFR1SRCLCK
SCHEMBL7855303 0.81 FGFR4 (0.39) EGFRFGFR1LCKMAPK14FGFR4
SCHEMBL7847396 0.81 ABL1 (0.39) WEE1EGFRFGFR1SRCLCK
SCHEMBL3968454 0.76 LCK (0.61) WEE1EGFRFGFR1SRCLCK
SCHEMBL4208611 0.66 FGFR4 (0.53) WEE1EGFRFGFR1LCKMAPK14
SCHEMBL3968867 0.65 LCK (0.51) WEE1FGFR1SRCLCKMAPK14
SCHEMBL3972422 0.64 LCK (0.65) WEE1EGFRFGFR1SRCLCK
SCHEMBL23653059 0.63 FGFR4 (0.64) WEE1EGFRFGFR1LCKMAPK14
SCHEMBL4479639 0.61 TNK2 (0.52) FGFR1SRCLCKFGFR4BRD4
SCHEMBL16665345 0.61 FGFR4 (0.53) FGFR1FGFR4FGFR2FGFR3KDR

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-1080092-A2 BICYCLIC PYRIMIDINES AND BICYCLIC 3,4-DIHYDROPYRIMIDINES AS INHIBITORS OF CELLULAR PROLIFERATION WARNER-LAMBERT COMPANY (US) 2001-03-07 EP disclosed
WO-1999061444-A2 BICYCLIC PYRIMIDINES AND BICYCLIC 3,4-DIHYDROPYRIMIDINES AS INHIBITORS OF CELLULAR PROLIFERATION WARNER-LAMBERT COMPANY (US) 1999-12-02 WO disclosed