SCHEMBL3373798

SCHEMBL3373798

CCOC(=O)C(CC(=O)c1ccccc1)OC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCCNC(=O)C(F)(F)F

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DPP8 Q6V1X1 4/20 0.43
DPP4 P27487 4/20 0.43
DPP9 Q86TI2 1/20 0.43
DPP7 Q9UHL4 1/20 0.43
ACE P12821 5/20 0.41
F2 P00734 1/20 0.40
LMNA P02545 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.37
TYMS P04818 1/20 0.36
CXCR3 P49682 3/20 0.36
PEPD P12955 1/20 0.36
ACE2 Q9BYF1 1/20 0.35

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
SCHEMBL5720655 0.89 ACE (0.52) DPP8DPP4DPP9DPP7ACE
SCHEMBL3369568 0.89 ACE (0.52) DPP8DPP4DPP9DPP7ACE
SCHEMBL9022277 0.89 ACE (0.52) DPP8DPP4DPP9DPP7ACE
SCHEMBL3372067 0.83 PEPD (0.39) DPP8DPP4DPP9DPP7F2
SCHEMBL3368639 0.82 KMT2A (0.43) DPP8DPP7SMN1; SMN2TYMSCXCR3
SCHEMBL9856515 0.82 KMT2A (0.43) DPP8DPP7SMN1; SMN2TYMSCXCR3
SCHEMBL3370866 0.82 ACE (0.49) DPP8DPP4DPP9DPP7ACE
SCHEMBL7275548 0.81 DPP4 (0.47) DPP8DPP4DPP9DPP7ACE
SCHEMBL7266839 0.77 DPP4 (0.53) DPP8DPP4DPP9DPP7ACE
SCHEMBL12886523 0.75 DPP4 (0.43) DPP8DPP4DPP9DPP7ACE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1679303-B1 Process for preparing 1-alkoxycarbonyl-3-phenylpropyl derivative KANEKA CORP (JP) 2010-09-15 EP disclosed
EP-1679303-A1 Process for preparing 1-alkoxycarbonyl-3-phenylpropyl derivative Kaneka Corporation (JP) 2006-07-12 EP disclosed
EP-0903337-B1 PROCESS FOR THE PREPARATION OF 1-ALKOXYCARBONYL-3-PHENYLPROPYL DERIVATIVES KANEKA CORP (JP) 2006-04-12 EP disclosed
EP-0903337-A1 PROCESS FOR THE PREPARATION OF 1-ALKOXYCARBONYL-3-PHENYLPROPYL DERIVATIVES KANEKA CORPORATION (JP) 1999-03-24 EP disclosed