SCHEMBL21131562

SCHEMBL21131562

COc1cc(C#Cc2nc(C3CN(C(C)=O)C3)n3ccnc(N)c23)cc(OC)c1

nearest known ligand 0.81

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ FGFR1 P11362 8/20 0.81
▸ FGFR2 P21802 10/20 0.79
▸ FGFR3 P22607 6/20 0.79
▸ FGFR4 P22455 9/20 0.75
▸ TNK2 Q07912 2/20 0.43
▸ KDR P35968 3/20 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
SCHEMBL21056240 0.90 FGFR4 (0.89) FGFR1FGFR2FGFR3FGFR4TNK2
SCHEMBL21050909 0.89 FGFR1 (1.00) FGFR1FGFR2FGFR3FGFR4KDR
SCHEMBL21050968 0.89 FGFR4 (0.89) FGFR1FGFR2FGFR3FGFR4
SCHEMBL21050893 0.89 FGFR2 (1.00) FGFR1FGFR2FGFR3FGFR4KDR
SCHEMBL21050890 0.89 FGFR2 (1.00) FGFR1FGFR2FGFR3FGFR4KDR
SCHEMBL21050975 0.86 FGFR4 (1.00) FGFR1FGFR2FGFR3FGFR4KDR
SCHEMBL21091458 0.86 FGFR4 (1.00) FGFR1FGFR2FGFR3FGFR4KDR
SCHEMBL21056238 0.86 FGFR4 (1.00) FGFR1FGFR2FGFR3FGFR4KDR
SCHEMBL21050930 0.85 FGFR4 (1.00) FGFR1FGFR2FGFR3FGFR4
SCHEMBL21056237 0.84 FGFR3 (0.73) FGFR1FGFR2FGFR3FGFR4TNK2

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-3498706-A1 HETEROCYCLIC COMPOUND AS FGFR INHIBITOR Guangzhou InnoCare Pharma Tech Co., Ltd. (CN) 2019-06-19 — — EP disclosed
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