SCHEMBL7929237

SCHEMBL7929237

CCCOc1ccc(-c2ccc3c(c2)O[C@H]([C@H](C)NC(C)=O)C3)cc1

nearest known ligand 0.51

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ACACB O00763 19/20 0.51
ACACA Q13085 11/20 0.51

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
SCHEMBL7922873 1.00 ACACB (0.51) ACACBACACA
SCHEMBL12432348 1.00 ACACB (0.51) ACACBACACA
SCHEMBL1391904 0.88 ACACB (0.55) ACACB
SCHEMBL7921328 0.88 ACACB (0.49) ACACBACACA
SCHEMBL12433361 0.88 ACACB (0.49) ACACBACACA
SCHEMBL1390996 0.88 ACACB (0.55) ACACB
SCHEMBL1391187 0.76 ACACB (0.57) ACACBACACA
SCHEMBL1391212 0.76 ACACB (0.57) ACACBACACA
SCHEMBL1391850 0.76 ACACB (0.52) ACACBACACA
SCHEMBL1390526 0.76 ACACB (0.57) ACACBACACA

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
WO-2010050445-A1 BICYCLIC COMPOUND 武田薬品工業株式会社 (JP) 2010-05-06 WO disclosed