SCHEMBL8601713

SCHEMBL8601713

CC(C)NC(=O)[C@@H](C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCCN

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DPP7 Q9UHL4 7/20 0.53
DPP4 P27487 5/20 0.53
DPP8 Q6V1X1 5/20 0.53
DPP9 Q86TI2 2/20 0.53
FAP Q12884 1/20 0.53
OPRM1 P35372 1/20 0.44
NTSR2 O95665 3/20 0.43
NTSR1 P30989 3/20 0.43
SORT1 Q99523 3/20 0.43
ITGB3 P05106 2/20 0.43
ITGA2B P08514 2/20 0.43
F2 P00734 1/20 0.43
NRP1 O14786 1/20 0.43
XIAP P98170 1/20 0.42

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
Acetic Acid SCHEMBL8574589 0.97 DPP4 (0.50) DPP7DPP4DPP8DPP9FAP
SCHEMBL29802257 0.91 NRP1 (0.53) DPP7DPP4DPP8DPP9FAP
SCHEMBL29801899 0.90 DPP4 (0.54) DPP7DPP4DPP8DPP9FAP
SCHEMBL29390399 0.90 DPP7 (0.54) DPP7DPP4DPP8DPP9FAP
SCHEMBL29802410 0.89 ACE (0.49) DPP7DPP4DPP8DPP9FAP
SCHEMBL30575175 0.89 DPP4 (0.48) DPP7DPP4DPP8DPP9FAP
SCHEMBL31039951 0.88 OPRM1 (0.56) DPP7DPP4DPP8DPP9FAP
SCHEMBL29801929 0.87 GRB2 (0.51) DPP7DPP4DPP8DPP9FAP
SCHEMBL2182612 0.86 DPP4 (0.46) DPP7DPP4DPP8DPP9FAP
SCHEMBL29801970 0.84 NTSR2 (0.46) DPP7DPP4DPP8DPP9FAP

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
WO-1998005300-A2 DELIVERY SYSTEM FOR PHARMACEUTICAL AGENTS ENCAPSULATED WITH OILS ABBOTT LABORATORIES (US) 1998-02-12 WO claimed
WO-1998005300-A2 DELIVERY SYSTEM FOR PHARMACEUTICAL AGENTS ENCAPSULATED WITH OILS ABBOTT LABORATORIES (US) 1998-02-12 WO disclosed