SCHEMBL28039508

SCHEMBL28039508

COCC(O)c1ccc(C#Cc2ccc([C]=O)cc2)cc1

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ACACB O00763 17/20 0.38
FFAR1 O14842 1/20 0.37
PYGL P06737 1/20 0.35
AOC3 Q16853 1/20 0.35

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
SCHEMBL28844839 0.84 PYGL (0.35) ACACBPYGLAOC3
SCHEMBL28205305 0.84 PYGL (0.35) ACACBPYGLAOC3
SCHEMBL28039529 0.79 FFAR1 (0.38) ACACBFFAR1
SCHEMBL28039740 0.79 FFAR1 (0.38) ACACBFFAR1
SCHEMBL28039783 0.79 FFAR1 (0.38) ACACBFFAR1
SCHEMBL19455152 0.77 AOC3 (0.38) PYGLAOC3
SCHEMBL16070733 0.77 AOC3 (0.38) PYGLAOC3
SCHEMBL16070740 0.76 CACNA2D1 (0.35) ACACBFFAR1PYGLAOC3
SCHEMBL28039743 0.76 FFAR1 (0.36) ACACBFFAR1AOC3
SCHEMBL28039490 0.75 FFAR1 (0.35) ACACBFFAR1

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
CN-105073710-A Novel hydroxamic acid derivative or salt thereof TOYAMA CHEMICAL CO LTD 2015-11-18 CN disclosed