SCHEMBL5260958

SCHEMBL5260958

[CH2]CC(C)C1CCNCC1

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CPN1 P15169 1/20 0.35
CPB2 Q96IY4 1/20 0.35
SLC6A2 P23975 3/20 0.34
SLC6A4 P31645 3/20 0.34
SLC6A3 Q01959 3/20 0.34
DPP4 P27487 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
SCHEMBL910730 0.82
SCHEMBL21137245 0.80 CPN1 (0.38) CPN1CPB2SLC6A2SLC6A4SLC6A3
SCHEMBL8133047 0.78 CPN1 (0.36) CPN1CPB2SLC6A2SLC6A4SLC6A3
SCHEMBL3653310 0.78 CPN1 (0.36) CPN1CPB2SLC6A2SLC6A4SLC6A3
SCHEMBL24170295 0.78 CPN1 (0.36) CPN1CPB2SLC6A2SLC6A4SLC6A3
SCHEMBL1193019 0.77
SCHEMBL497976 0.77
SCHEMBL121101 0.76 CPN1 (0.39) CPN1CPB2SLC6A2SLC6A4SLC6A3
SCHEMBL10206052 0.76 CPN1 (0.39) CPN1CPB2SLC6A2SLC6A4SLC6A3
Hydrochloric Acid SCHEMBL30004842 0.76 SLC6A2 (0.37) CPN1CPB2SLC6A2SLC6A4SLC6A3

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
CN-1930139-B Derivatives of hydroxamic acid as metalloproteinase inhibitors VERNALIS OXFORD LTD 2011-07-27 CN disclosed
CN-100352806-C 4-piperidinyl alkylamine derivatives as muscarinic receptor antagonists HOFFMANN LA ROCHE (CH) 2007-12-05 CN disclosed
EP-1773817-A1 SUBSTITUTED ARYL-AMINE DERIVATIVES AND METHODS OF USE Amgen Inc. (US) 2007-04-18 EP disclosed
CN-1930139-A Derivatives of hydroxamic acid as metalloproteinase inhibitors VERNALIS OXFORD LTD (GB) 2007-03-14 CN disclosed
WO-2006012374-A1 SUBSTITUTED ARYL-AMINE DERIVATIVES AND METHODS OF USE AMGEN INC. (US) 2006-02-02 WO disclosed
CN-1599722-A 4-piperidinyl alkylamine derivatives as muscarinic receptor antagonists HOFFMANN LA ROCHE (CH) 2005-03-23 CN disclosed