SCHEMBL7652246

SCHEMBL7652246

CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1c2ccc(Cl)c(Cl)c2C[C@@H]1C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ACE P12821 1/20 0.39
CTSK P43235 5/20 0.38
CTSS P25774 1/20 0.38
KMT2A Q03164 2/20 0.37
MC4R P32245 1/20 0.37
PPARG P37231 1/20 0.36
PPARA Q07869 1/20 0.36
ALDH1A1 P00352 2/20 0.35
MAPT P10636 2/20 0.35
AGTR2 P50052 1/20 0.35
DRD2 P14416 2/20 0.35
CACNA1B Q00975 1/20 0.35
KDM4E B2RXH2 1/20 0.35
GAA P10253 1/20 0.35
PKM P14618 1/20 0.35
HPGD P15428 1/20 0.35
ALOX12 P18054 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
SCHEMBL5567555 1.00 ACE (0.39) ACECTSKCTSSKMT2AMC4R
SCHEMBL7658235 1.00 ACE (0.39) ACECTSKCTSSKMT2AMC4R
SCHEMBL7653212 0.91 MC4R (0.37) ACECTSKCTSSKMT2AMC4R
SCHEMBL5567466 0.91 MC4R (0.37) ACECTSKCTSSKMT2AMC4R
SCHEMBL5569562 0.90 AGTR2 (0.41) ACECTSKCTSSKMT2AMC4R
SCHEMBL5568420 0.90 AGTR2 (0.41) ACECTSKCTSSKMT2AMC4R
SCHEMBL7650981 0.86 KDM4E (0.45) CTSKKMT2AALDH1A1DRD2KDM4E
SCHEMBL5568286 0.86 CTSK (0.34) ACECTSKCTSSKMT2AMC4R
SCHEMBL5563898 0.86 CTSK (0.34) ACECTSKCTSSKMT2AMC4R
SCHEMBL5563646 0.84 AGTR2 (0.41) ACECTSKCTSSKMT2AAGTR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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