SCHEMBL649163

SCHEMBL649163

NCCCC[C@H](N)C(=O)N1CCC[C@H]1C(=O)OC(CCc1ccccc1)C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ACE P12821 6/20 0.58
DPP8 Q6V1X1 2/20 0.53
F2 P00734 2/20 0.47
FKBP1A P62942 1/20 0.46
DPP4 P27487 1/20 0.46
FAP Q12884 1/20 0.46
DPP9 Q86TI2 1/20 0.46
DPP7 Q9UHL4 1/20 0.46

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
SCHEMBL11196591 0.92 ACE (0.52) ACEDPP8F2FKBP1ADPP4
SCHEMBL11191259 0.89 ACE (0.55) ACEDPP8FKBP1ADPP4DPP9
SCHEMBL11195194 0.88 ACE (0.52) ACEDPP8FKBP1ADPP4DPP9
SCHEMBL10882970 0.87 ACE (0.50) ACEDPP8FKBP1ADPP4DPP9
SCHEMBL10882819 0.86 ACE (0.51) ACEDPP8FKBP1ADPP4DPP9
SCHEMBL3370866 0.85 ACE (0.49) ACEDPP8F2FKBP1ADPP4
SCHEMBL11192710 0.85 ACE (0.51) ACEDPP8FKBP1ADPP4DPP9
SCHEMBL10881981 0.85 ACE (0.49) ACEDPP8FKBP1ADPP4DPP9
SCHEMBL11190870 0.85 ACE (0.49) ACEDPP8F2FKBP1ADPP4
SCHEMBL11195321 0.85 ACE (0.50) ACEDPP8FKBP1ADPP4DPP9

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
US-8119817-B2 Process for separating the diastereomers of RSS-and SSS-N- α [1-carboxy-3-phenylpropyl] lysylproline DEGUSSA-HUELS AG (DE) 2012-02-21 US disclosed
US-20110077412-A1 Process for separating the diastereomers of RSS-snd SSS-N- a [1-carboxy -3-Phenylpropyl] lysylproline DEGUSSA-HUELS AG (DE) 2011-03-31 US disclosed