SCHEMBL12475738

SCHEMBL12475738

CCOc1ccc(C(C)NC(C)=O)cc1

nearest known ligand 0.86

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ACACB O00763 18/20 0.86
ACACA Q13085 3/20 0.83
HPGD P15428 1/20 0.63
LMNA P02545 1/20 0.63

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
SCHEMBL256178 0.95 ACACB (0.92) ACACBACACA
SCHEMBL12001416 0.95 ACACB (0.92) ACACBACACA
SCHEMBL11998832 0.93 ACACB (1.00) ACACBACACA
SCHEMBL256519 0.93 ACACB (1.00) ACACBACACA
SCHEMBL3726815 0.85 ACACB (0.74) ACACBACACA
SCHEMBL12001374 0.83 ACACB (0.92) ACACBACACA
SCHEMBL15048035 0.82 ACACB (1.00) ACACB
SCHEMBL15048247 0.82 ACACB (1.00) ACACB
SCHEMBL12001207 0.81 ACACB (0.80) ACACBACACA
SCHEMBL12001778 0.81 ACACB (0.80) ACACBACACAHPGDLMNA

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-2012090219-A2 THIAZOLE COMPOUNDS USEFUL AS ACETYL-COA CARBOXYLASE (ACC) INHIBITORS JUBILANT BIOSYS LTD. (IN) 2012-07-05 WO disclosed