SCHEMBL21131362

SCHEMBL21131362

COc1cc(C#Cc2nc([C@@H]3CCN(C=O)C3)n3ccnc(N)c23)cc(OC)c1

nearest known ligand 0.72

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ FGFR4 P22455 10/20 0.72
▸ FGFR1 P11362 8/20 0.72
▸ FGFR3 P22607 6/20 0.72
▸ FGFR2 P21802 8/20 0.67
▸ TNK2 Q07912 4/20 0.41
▸ KDR P35968 2/20 0.39
▸ BTK Q06187 1/20 0.39

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
SCHEMBL21131363 1.00 FGFR4 (0.72) FGFR4FGFR1FGFR3FGFR2TNK2
SCHEMBL21131365 0.87 FGFR4 (0.74) FGFR4FGFR1FGFR3FGFR2TNK2
SCHEMBL29592326 0.84 FGFR3 (0.86) FGFR4FGFR1FGFR3FGFR2TNK2
SCHEMBL21056236 0.84 FGFR4 (1.00) FGFR4FGFR1FGFR3FGFR2KDR
SCHEMBL21050832 0.84 FGFR4 (1.00) FGFR4FGFR1FGFR3FGFR2KDR
SCHEMBL21050780 0.84 FGFR4 (1.00) FGFR4FGFR1FGFR3FGFR2KDR
SCHEMBL21091458 0.84 FGFR4 (1.00) FGFR4FGFR1FGFR3FGFR2KDR
SCHEMBL21056238 0.84 FGFR4 (1.00) FGFR4FGFR1FGFR3FGFR2KDR
SCHEMBL21050975 0.84 FGFR4 (1.00) FGFR4FGFR1FGFR3FGFR2KDR
SCHEMBL21056242 0.83 FGFR4 (1.00) FGFR4FGFR1FGFR3FGFR2KDR

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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