SCHEMBL4590995

SCHEMBL4590995

CC(=O)N1CCC(C(C)N)CC1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 7/20 0.44
DPP7 Q9UHL4 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.43
PIK3CD O00329 1/20 0.42
EPHX2 P34913 5/20 0.42
EPHX1 P07099 1/20 0.42
CYP1A2 P05177 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
DPP8 Q6V1X1 2/20 0.40
DPP9 Q86TI2 2/20 0.40
KDM4E B2RXH2 1/20 0.39
CASP6 P55212 1/20 0.38
GFER P55789 1/20 0.38

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
SCHEMBL20601112 0.83 DPP4 (0.40) DPP4DPP7DPP8DPP9
SCHEMBL1010495 0.83 DPP4 (0.40) DPP4DPP7DPP8DPP9
SCHEMBL20600972 0.83 DPP4 (0.40) DPP4DPP7DPP8DPP9
SCHEMBL19064404 0.83 DPP4 (0.40) DPP4DPP7DPP8DPP9
SCHEMBL680019 0.83 PIK3CD (0.45) DPP4DPP7SMN1; SMN2PIK3CDEPHX2
SCHEMBL14018492 0.82 MEN1 (0.44) DPP4DPP7DPP8DPP9
SCHEMBL14018532 0.80 EPHX2 (0.47) DPP4DPP7EPHX2EPHX1DPP8
SCHEMBL3465333 0.80 DPP4 (0.52) DPP4DPP7PIK3CDEPHX2EPHX1
SCHEMBL15722292 0.79 PIK3CD (0.42) DPP4DPP7SMN1; SMN2PIK3CDEPHX2
SCHEMBL25792014 0.79 PIK3CD (0.42) DPP4DPP7SMN1; SMN2PIK3CDEPHX2

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1910362-A1 IMIDAZOPYRIDINE DERIVATIVES AS SIRTUIN MODULATING AGENTS Sirtris Pharmaceuticals, Inc. (US) 2008-04-16 EP disclosed
EP-1909910-A1 BENZIMIDAZOLE DERIVATIVES AS SIRTUIN MODULATORS Sirtris Pharmaceuticals, Inc. (US) 2008-04-16 EP disclosed
EP-1910380-A1 OXAZOLOPYRIDINE DERIVATIVES AS SIRTUIN MODULATORS Sirtris Pharmaceuticals, Inc. (US) 2008-04-16 EP disclosed
EP-1910384-A1 IMIDAZO [2,1-B]THIAYOLE DERIVATIVES AS SIRTUIN MODULATING COMPOUNDS Sirtris Pharmaceuticals, Inc. (US) 2008-04-16 EP disclosed
WO-2007019344-A1 IMIDAZO [2,1-B] THIAYOLE DERIVATIVES AS SIRTUIN MODULATING COMPOUNDS SIRTRIS PHARMACEUTICALS, INC. (US) 2007-02-15 WO disclosed
WO-2007019417-A1 OXAZOLOPYRIDINE DERIVATIVES AS SIRTUIN MODULATORS SIRTRIS PHARMACEUTICALS, INC. (US) 2007-02-15 WO disclosed
WO-2007019416-A1 BENZIMIDAZOLE DERIVATIVES AS SIRTUIN MODULATORS SIRTRIS PHARMACEUTICALS, INC. (US) 2007-02-15 WO disclosed
WO-2007019345-A1 IMIDAZOPYRIDINE DERIVATIVES AS SIRTUIN MODULATING AGENTS SIRTRIS PHARMACEUTICALS, INC. (US) 2007-02-15 WO disclosed