SCHEMBL21252199

SCHEMBL21252199

COc1cc(OC)c(F)c(-c2cc3cnc(N)nc3c(N3CC4(COC4)C3)n2)c1F

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ TTK P33981 12/20 0.39
▸ GAK O14976 1/20 0.39
▸ MAP3K12 Q12852 3/20 0.37
▸ JAK2 O60674 3/20 0.34
▸ JAK1 P23458 3/20 0.34
▸ TYK2 P29597 3/20 0.34
▸ KDR P35968 3/20 0.34
▸ JAK3 P52333 3/20 0.34
▸ AURKB Q96GD4 3/20 0.34

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
SCHEMBL21252187 0.88 TTK (0.41) TTKGAKMAP3K12JAK2JAK1
SCHEMBL24488400 0.88 MAP3K12 (0.38) TTKMAP3K12JAK2JAK1TYK2
SCHEMBL21240493 0.87 TTK (0.38) TTKGAK
SCHEMBL29578139 0.87 TTK (0.38) TTKGAK
SCHEMBL21251781 0.86 JAK2 (0.36) TTKMAP3K12JAK2JAK1TYK2
SCHEMBL21252086 0.86 JAK2 (0.38) TTKMAP3K12JAK2JAK1TYK2
SCHEMBL21252019 0.85 TTK (0.37) TTKGAKMAP3K12JAK2JAK1
SCHEMBL21252225 0.85 NOS1 (0.45) GAK
SCHEMBL21252008 0.84 GAK (0.37) TTKGAKMAP3K12
SCHEMBL24488377 0.83 NOS1 (0.44) GAKJAK2JAK1TYK2KDR

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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