SCHEMBL3724464

SCHEMBL3724464

CCCOc1ccc(Oc2ccc3cc(C(C)NC(C)=O)ccc3c2)c(C)c1

nearest known ligand 0.60

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ACACB O00763 20/20 0.60
ACACA Q13085 7/20 0.60

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
SCHEMBL13076810 0.91 ACACB (0.58) ACACBACACA
SCHEMBL3721938 0.88 ACACB (0.59) ACACBACACA
SCHEMBL13077226 0.88 ACACB (0.55) ACACBACACA
SCHEMBL3726407 0.87 ACACB (0.52) ACACBACACA
SCHEMBL13076809 0.87 ACACB (0.76) ACACBACACA
SCHEMBL3726184 0.85 ACACB (0.66) ACACBACACA
SCHEMBL3726321 0.85 CYP2C9 (0.52) ACACBACACA
SCHEMBL13077220 0.85 ACACB (0.65) ACACBACACA
SCHEMBL3720744 0.83 ACACB (0.51) ACACBACACA
SCHEMBL3723840 0.82 ACACB (0.59) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010127208-A1 INHIBITORS OF ACETYL-COA CARBOXYLASE FOREST LABORATORIES HOLDINGS LIMITED (BM) 2010-11-04 WO disclosed
WO-2010127208-A1 INHIBITORS OF ACETYL-COA CARBOXYLASE FOREST LABORATORIES HOLDINGS LIMITED (BM) 2010-11-04 WO disclosed