SCHEMBL8294302

SCHEMBL8294302

CN(C(=O)CNCCCc1ccccc1)C1CCC1

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 2/20 0.49
L3MBTL1 Q9Y468 1/20 0.47
OPRM1 P35372 2/20 0.46
OPRL1 P41146 2/20 0.46
SIGMAR1 Q99720 2/20 0.46
EPHX1 P07099 1/20 0.46
EPHX2 P34913 4/20 0.44
DPP7 Q9UHL4 1/20 0.44
KMT2A Q03164 1/20 0.44
ATM Q13315 1/20 0.44

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
SCHEMBL8294306 0.92 DPP7 (0.52) DPP4L3MBTL1OPRM1SIGMAR1EPHX1
SCHEMBL8294300 0.83 KMT2A (0.48) DPP4L3MBTL1OPRM1OPRL1DPP7
SCHEMBL4278254 0.80 L3MBTL1 (0.60) L3MBTL1SIGMAR1EPHX1EPHX2KMT2A
SCHEMBL158734 0.73 SIGMAR1 (0.67) L3MBTL1SIGMAR1
SCHEMBL4283829 0.73 CCR5 (0.62) L3MBTL1SIGMAR1EPHX2KMT2AATM
SCHEMBL7576695 0.72 ATM (0.62) L3MBTL1EPHX1KMT2AATM
SCHEMBL7390477 0.72 CYP2D6 (0.67) OPRM1SIGMAR1KMT2AATM
SCHEMBL9543983 0.71 SIGMAR1 (0.58) L3MBTL1SIGMAR1KMT2A
SCHEMBL8015490 0.71 LTA4H (0.66) SIGMAR1KMT2A
SCHEMBL13434079 0.70 CCR5 (0.63) SIGMAR1

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-2005025554-A2 DIPEPTIDYL PEPTIDASE IV INHIBITOR JAPAN TOBACCO INC. (JP) 2005-03-24 WO disclosed