SCHEMBL18860959

SCHEMBL18860959

CNc1ccc(-c2cc(-c3ccc(OC)c(OC(=O)CO)c3)cnc2N)c(F)c1

nearest known ligand 0.52

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ CHEK2 O96017 3/20 0.52
▸ CHEK1 O14757 2/20 0.52
▸ FYN P06241 5/20 0.50
▸ AXL P30530 13/20 0.49
▸ MERTK Q12866 13/20 0.49

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
SCHEMBL18861126 0.93 CHEK2 (0.52) CHEK2CHEK1FYNAXLMERTK
SCHEMBL18861081 0.89 CHEK2 (0.55) CHEK2CHEK1FYNAXLMERTK
SCHEMBL18860989 0.87 FYN (0.55) CHEK2CHEK1FYNAXLMERTK
SCHEMBL23158630 0.84 CHEK2 (0.61) CHEK2CHEK1FYNAXLMERTK
SCHEMBL18860414 0.81 CHEK2 (0.66) CHEK2CHEK1FYN
SCHEMBL18861171 0.80 FYN (0.46) CHEK2CHEK1FYNAXLMERTK
SCHEMBL26946789 0.78 FYN (0.46) CHEK2CHEK1FYNAXLMERTK
SCHEMBL19048389 0.78 CHEK1 (0.53) CHEK2CHEK1FYNAXLMERTK
SCHEMBL18860437 0.77 FYN (0.69) CHEK2CHEK1FYN
SCHEMBL23158768 0.76 CHEK2 (0.55) CHEK2CHEK1FYN

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-3168219-A1 PYRIDONE DERIVATIVE HAVING TETRAHYDROPYRANYL METHYL GROUP DAIICHI SANKYO COMPANY, LIMITED (JP) 2017-05-17 — — EP disclosed
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