SCHEMBL18861079

SCHEMBL18861079

COc1ccc(-c2cnc(N)c(-c3ccc(N(F)/C(C)=C/N/C=C(\C)c4ncc(C)cn4)cc3)c2)cc1OC

nearest known ligand 0.50

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ FYN P06241 13/20 0.50
▸ CHEK2 O96017 4/20 0.49
▸ CHEK1 O14757 2/20 0.49
▸ TGFBR1 P36897 2/20 0.41
▸ AXL P30530 3/20 0.40
▸ MERTK Q12866 3/20 0.40

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
SCHEMBL23158685 0.91 CHEK2 (0.53) FYNCHEK2CHEK1TGFBR1AXL
SCHEMBL18860363 0.85 CHEK2 (0.47) FYNCHEK2CHEK1TGFBR1AXL
SCHEMBL23158671 0.83 CHEK1 (0.46) FYNCHEK2CHEK1TGFBR1AXL
SCHEMBL18861342 0.83 CHEK1 (0.46) FYNCHEK2CHEK1TGFBR1AXL
SCHEMBL18860964 0.78 FYN (0.47) FYNCHEK2CHEK1TGFBR1AXL
SCHEMBL23158727 0.77 CHEK2 (0.42) FYNCHEK2CHEK1TGFBR1AXL
SCHEMBL23158702 0.72 CHEK2 (0.53) FYNCHEK2CHEK1AXLMERTK
SCHEMBL29576661 0.70 FYN (0.76) FYNCHEK2CHEK1TGFBR1
SCHEMBL15334401 0.70 FYN (0.76) FYNCHEK2CHEK1TGFBR1
SCHEMBL23158688 0.69 AXL (0.51) FYNCHEK2CHEK1AXLMERTK

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-3168219-B1 PYRIDONE DERIVATIVE HAVING TETRAHYDROPYRANYL METHYL GROUP DAIICHI SANKYO CO LTD (JP) 2021-03-31 — — EP disclosed
EP-3168219-A1 PYRIDONE DERIVATIVE HAVING TETRAHYDROPYRANYL METHYL GROUP DAIICHI SANKYO COMPANY, LIMITED (JP) 2017-05-17 — — EP disclosed
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