SCHEMBL8260262

SCHEMBL8260262

CCCCS(=O)(=O)NCC12CC3CC(C1)CC(NCC(=O)N1CSC[C@@H]1C#N)(C3)C2

nearest known ligand 0.53

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 16/20 0.53
DPP9 Q86TI2 2/20 0.42
DPP8 Q6V1X1 2/20 0.42
FAP Q12884 1/20 0.42
DPP7 Q9UHL4 1/20 0.36

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
SCHEMBL5806239 0.81 DPP4 (0.57) DPP4DPP9DPP8FAP
SCHEMBL5806233 0.81 DPP4 (0.57) DPP4DPP9DPP8FAP
SCHEMBL5819747 0.79 DPP4 (0.51) DPP4DPP9DPP8FAPDPP7
SCHEMBL2847016 0.71 DPP4 (0.47) DPP4DPP9DPP8FAPDPP7
SCHEMBL13025325 0.71 DPP4 (0.47) DPP4DPP9DPP8FAP
SCHEMBL6375288 0.70 DPP4 (1.00) DPP4DPP9DPP8FAP
SCHEMBL5820282 0.67 DPP4 (0.68) DPP4DPP9DPP8FAP
SCHEMBL8261998 0.67 DPP4 (0.68) DPP4DPP9DPP8FAP
SCHEMBL5585963 0.66 DPP4 (0.73) DPP4DPP9DPP8FAP
SCHEMBL2871206 0.66 DPP4 (0.73) DPP4DPP9DPP8FAP

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-2006090244-A1 NEW ADAMANTANE DERIVATIVES AS DIPEPTIDYL, PEPTIDASE IV INHIBITORS, PROCESSES FOR THEIR PREPARATION, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM GLENMARK PHARMACEUTICALS S.A. (US) 2006-08-31 WO disclosed