SCHEMBL1165288

SCHEMBL1165288

CCOc1cc(C(=O)C2C(=O)c3cc(-c4nnn[nH]4)ccc3OC23CCNCC3)cc2c1c(C)cn2C1CC1

nearest known ligand 0.40

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ACACB O00763 1/20 0.40
ACACA Q13085 1/20 0.40

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
SCHEMBL2363125 1.00 ACACB (0.40) ACACBACACA
SCHEMBL3857065 0.93 ACACB (0.47) ACACBACACA
SCHEMBL3856567 0.88
SCHEMBL4784594 0.87 ACACB (0.45) ACACBACACA
SCHEMBL3858972 0.85 ACACB (0.57) ACACBACACA
SCHEMBL3861926 0.84 ACACB (0.43) ACACBACACA
SCHEMBL3858724 0.83 ACACB (0.34) ACACBACACA
SCHEMBL4517085 0.83 ACACB (0.37) ACACBACACA
SCHEMBL2360849 0.82 ACACB (0.34) ACACBACACA
SCHEMBL1535057 0.82 ACACB (0.34) 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2013068328-A1 BICYCLO [2.2.2] OCTAN-1-YLCARBOXYLIC ACID COMPOUNDS AS DGAT-1 INHIBITORS INTERVET INTERNATIONAL B.V. (NL) 2013-05-16 WO disclosed
EP-2558094-A1 PYRIDONE DERIVATIVES Merck Sharp & Dohme Corp. (US) 2013-02-20 EP disclosed
WO-2012164071-A1 IMIDAZOLE DERIVATIVES INTERVET INTERNATIONAL B.V. (NL) 2012-12-06 WO disclosed
EP-2464228-A1 SUBSTITUTED CYCLOPROPYL COMPOUNDS, COMPOSITIONS CONTAINING SUCH COMPOUNDS AND METHODS OF TREATMENT Merck Sharp & Dohme Corp. (US) 2012-06-20 EP disclosed
WO-2011130086-A1 PYRIDONE DERIVATIVES MERCK SHARP & DOHME CORP. (US) 2011-10-20 WO disclosed
WO-2011019538-A1 SUBSTITUTED CYCLOPROPYL COMPOUNDS, COMPOSITIONS CONTAINING SUCH COMPOUNDS AND METHODS OF TREATMENT MERCK SHARP & DOHME CORP. (US) 2011-02-17 WO disclosed