SCHEMBL24488291

SCHEMBL24488291

COc1cc(OC)c(Cl)c(-c2cc3cnc(N)nc3c(N3CCC(C)(O)C3)n2)c1Cl

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ TTK P33981 2/20 0.36
▸ CNR2 P34972 7/20 0.35
▸ FGFR1 P11362 2/20 0.35
▸ FGFR2 P21802 1/20 0.35
▸ JAK2 O60674 1/20 0.35
▸ JAK1 P23458 1/20 0.35
▸ TYK2 P29597 1/20 0.35
▸ KDR P35968 1/20 0.35
▸ JAK3 P52333 1/20 0.35
▸ AURKB Q96GD4 1/20 0.35
▸ MAP3K12 Q12852 2/20 0.35
▸ PDCD1 Q15116 2/20 0.34
▸ CD274 Q9NZQ7 2/20 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
SCHEMBL21252267 0.94 PDE10A (0.36) TTKFGFR1FGFR2JAK2JAK1
SCHEMBL21252289 0.93 MAP3K12 (0.37) TTKCNR2FGFR1FGFR2JAK2
SCHEMBL24488267 0.92 JAK2 (0.37) TTKFGFR1FGFR2JAK2JAK1
SCHEMBL24488375 0.89 FGFR1 (0.35) TTKFGFR1FGFR2JAK2JAK1
SCHEMBL21252298 0.89 TTK (0.38) TTKCNR2JAK2JAK1TYK2
SCHEMBL21252238 0.88 MAP3K12 (0.41) TTKCNR2MAP3K12
SCHEMBL21251663 0.87 NOS1 (0.36) TTKFGFR1FGFR2JAK2JAK1
SCHEMBL24488350 0.86 TTK (0.38) TTKFGFR1FGFR2JAK2JAK1
SCHEMBL21252208 0.86 TTK (0.38) TTKFGFR1FGFR2JAK2JAK1
SCHEMBL21252435 0.85 JAK2 (0.38) TTKFGFR1FGFR2JAK2JAK1

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-3524603-B1 FGFR4 INHIBITOR, PREPARATION METHOD THEREFOR AND PHARMACEUTICAL USE THEREOF ABBISKO THERAPEUTICS CO LTD (CN) 2022-06-08 — — EP disclosed
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