SCHEMBL25773201

SCHEMBL25773201

COc1cc(C(=O)O)c(F)cc1Nc1ncc(C(F)(F)F)c(Oc2cccc3c2C(=O)N(C)C3)n1

nearest known ligand 0.80

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ PTK2 Q05397 20/20 0.80

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
SCHEMBL25773198 0.94 PTK2 (0.80) PTK2
SCHEMBL19918806 0.93 PTK2 (0.79) PTK2
SCHEMBL30458567 0.93 PTK2 (0.79) PTK2
SCHEMBL18309610 0.92 PTK2 (0.81) PTK2
SCHEMBL25638199 0.89 PTK2 (0.76) PTK2
Ifebemtinib SCHEMBL29767371 0.89 PTK2 (1.00) PTK2
Ifebemtinib SCHEMBL12135026 0.89 PTK2 (1.00) PTK2
Ifebemtinib SCHEMBL31008531 0.88 PTK2 (0.99) PTK2
SCHEMBL12135408 0.88 PTK2 (1.00) PTK2
SCHEMBL31105493 0.88 PTK2 (0.88) PTK2

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-2023116527-A1 COMPOUND AS FAK INHIBITOR AND USE THEREOF 微境生物医药科技(上海)有限公司 2023-06-29 — — WO disclosed
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