SCHEMBL21252476

SCHEMBL21252476

COc1cc(OC)c(F)c(-c2cc3cnc(N)cc3c(N3CC(C)(OC)C3)n2)c1F

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ MAP3K12 Q12852 3/20 0.34
▸ PIK3CA P42336 1/20 0.31
▸ MTOR P42345 1/20 0.31
▸ MAP4K1 Q92918 1/20 0.30

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
SCHEMBL21252283 0.92 MAP3K12 (0.32) MAP3K12PIK3CAMTORMAP4K1
SCHEMBL21252007 0.90 PIK3CA (0.36) PIK3CAMTORMAP4K1
SCHEMBL20331732 0.89 ABL1 (0.32) MAP3K12MAP4K1
SCHEMBL21240064 0.88 PDE9A (0.32) MAP3K12MAP4K1
SCHEMBL21252482 0.88 FGFR4 (0.37) MAP3K12PIK3CAMTOR
SCHEMBL21252008 0.86 GAK (0.37) MAP3K12PIK3CAMTOR
SCHEMBL21252220 0.85 PIK3CA (0.33) MAP3K12PIK3CAMTORMAP4K1
SCHEMBL20332008 0.84 FGFR4 (0.35) MAP3K12
SCHEMBL21251781 0.84 JAK2 (0.36) MAP3K12
SCHEMBL21252311 0.83 MAP4K1 (0.33) MAP3K12PIK3CAMTORMAP4K1

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-3524603-B1 FGFR4 INHIBITOR, PREPARATION METHOD THEREFOR AND PHARMACEUTICAL USE THEREOF ABBISKO THERAPEUTICS CO LTD (CN) 2022-06-08 — — EP disclosed
EP-3524603-A1 FGFR4 INHIBITOR, PREPARATION METHOD THEREFOR AND PHARMACEUTICAL USE THEREOF Abbisko Therapeutics Co., Ltd. (CN) 2019-08-14 — — EP disclosed
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