SCHEMBL4049905

SCHEMBL4049905

CCN1CCC(n2cc(-c3cnc(N)c(-c4nc5cc(F)ccc5[nH]4)n3)cn2)CC1

nearest known ligand 0.64

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
EGFR P00533 3/20 0.64
FGFR1 P11362 13/20 0.47
FGFR2 P21802 13/20 0.47
FGFR3 P22607 13/20 0.47
MET P08581 1/20 0.43
NTRK1 P04629 1/20 0.43
ATR Q13535 2/20 0.42

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
SCHEMBL4044231 0.91 EGFR (0.78) EGFRFGFR1FGFR2FGFR3MET
SCHEMBL4042032 0.87 EGFR (0.62) EGFRFGFR1FGFR2FGFR3MET
SCHEMBL4044782 0.86 EGFR (0.61) EGFRFGFR1FGFR2FGFR3MET
SCHEMBL4045787 0.84 EGFR (0.78) EGFRFGFR1FGFR2FGFR3MET
SCHEMBL4045589 0.83 EGFR (0.56) EGFRFGFR1FGFR2FGFR3MET
SCHEMBL4047605 0.82 EGFR (0.62) EGFRFGFR1FGFR2FGFR3MET
SCHEMBL4041919 0.81 EGFR (0.79) EGFRFGFR1FGFR2FGFR3ATR
SCHEMBL4045492 0.81 EGFR (0.78) EGFRFGFR1FGFR2FGFR3MET
SCHEMBL4043377 0.81 EGFR (0.78) EGFRFGFR1FGFR2FGFR3NTRK1
SCHEMBL4045605 0.80 EGFR (0.74) EGFRFGFR1FGFR2FGFR3MET

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
WO-2009024825-A1 2-PYRAZINYLBENZIMIDAZOLE DERIVATIVES AS RECEPTOR TYROSINE KINASE INHIBITORS ASTRAZENECA AB (SE) 2009-02-26 WO disclosed