SCHEMBL18598447

SCHEMBL18598447

C#C[C@@H]1CCCCCCN1C(C)(C)C

nearest known ligand 0.31

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.31
CHRM2 P08172 1/20 0.31
CHRM4 P08173 1/20 0.31
CHRM5 P08912 1/20 0.31
CHRM1 P11229 1/20 0.31
CHRM3 P20309 1/20 0.31
HPGD P15428 1/20 0.30

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
SCHEMBL18598177 1.00 HTT (0.31) HTTCHRM2CHRM4CHRM5CHRM1
SCHEMBL25664676 0.92 HTT (0.33) HTT
SCHEMBL29610558 0.92 HTT (0.33) HTT
SCHEMBL25664690 0.92 HTT (0.33) HTT
SCHEMBL2601398 0.78 DPP4 (0.39)
SCHEMBL4758300 0.72
SCHEMBL15316993 0.72
SCHEMBL24121374 0.71 DPP4 (0.44)
SCHEMBL2601399 0.71 DPP4 (0.44)
SCHEMBL20748227 0.70 HTT (0.35) HTTCHRM5HPGD

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
EP-2326616-B1 PROCESS FOR THE SYNTHESIS OF EZETIMIBE AND INTERMEDIATES USEFUL THEREFORE LEK PHARMACEUTICALS (SI) 2017-03-08 EP disclosed