SCHEMBL5568393

SCHEMBL5568393

CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1c2cc(Cl)c(Cl)cc2C[C@H]1C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CTSS P25774 1/20 0.39
CTSK P43235 1/20 0.39
ACE P12821 5/20 0.38
MC4R P32245 1/20 0.38
KMT2A Q03164 1/20 0.36
MME P08473 1/20 0.36

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
SCHEMBL5567585 0.91 MC4R (0.37) CTSSCTSKMC4RKMT2A
SCHEMBL5563362 0.88 MC4R (0.42) ACEMC4R
SCHEMBL7668349 0.88 MC4R (0.42) ACEMC4R
SCHEMBL5568361 0.87 ACE (0.40) CTSSCTSKACE
SCHEMBL5568446 0.86 ACE (0.42) CTSSCTSKACE
SCHEMBL5563327 0.86 CXCR3 (0.35) CTSSCTSKMC4RKMT2A
SCHEMBL5568411 0.83 ACE (0.55) ACEMME
SCHEMBL5566971 0.83 HDAC8 (0.42)
SCHEMBL5568646 0.83 HDAC8 (0.42)
SCHEMBL5567555 0.83 ACE (0.39) CTSSCTSKACEMC4RKMT2A

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-1042288-B1 TRIPEPTIDYL PEPTIDASE INHIBITORS INST NAT SANTE RECH MED (FR) 2007-11-07 EP disclosed
US-6335360-B1 INDOLINE-2-CARBOXYLIC AMIDE DERIVATIVES; OBESITY, EATING AND PSYCHOLOGICAL DISORDERS INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) 2002-01-01 US disclosed
EP-1042288-A1 TRIPEPTIDYL PEPTIDASE INHIBITORS INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) 2000-10-11 EP disclosed
WO-1999033801-A1 TRIPEPTIDYL PEPTIDASE INHIBITORS INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) 1999-07-08 WO disclosed