SCHEMBL6980126

SCHEMBL6980126

NC(=O)C1CCCN1C(=O)C(c1ccccc1)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AGTR2 P50052 17/20 0.52
DPP4 P27487 2/20 0.49

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
SCHEMBL31376320 0.87 DPP4 (0.65) DPP4
SCHEMBL13570514 0.87 F2 (0.53) DPP4
SCHEMBL2170169 0.87 SCN9A (0.54) AGTR2DPP4
SCHEMBL8536863 0.85 DPP4 (0.49) DPP4
SCHEMBL22333690 0.84 AGTR2 (0.60) AGTR2
SCHEMBL22333647 0.84 AGTR2 (0.60) AGTR2
SCHEMBL28797928 0.83 ERAP2 (0.48) DPP4
SCHEMBL3733552 0.83 LMNA (0.52) DPP4
SCHEMBL17220302 0.82 GAA (0.54) DPP4
SCHEMBL2176481 0.82 KCNH2 (0.47) DPP4

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
EP-1268418-A1 PHARMACEUTICALLY ACTIVE PYRROLIDINE DERIVATIVES AS BAX INHIBITORS Applied Research Systems ARS Holding N.V. (AN) 2003-01-02 EP disclosed
WO-2001074769-A1 PHARMACEUTICALLY ACTIVE PYRROLIDINE DERIVATIVES AS BAX INHIBITORS APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. (AN) 2001-10-11 WO disclosed