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SCHEMBL5564853

SCHEMBL5564853

C[C@H](NC(=O)OC(C)(C)C)C(=O)N1c2ccc(Cl)cc2C[C@@H]1C(=O)O

nearest known ligand 0.61

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ ACE P12821 4/20 0.45
▸ MME P08473 1/20 0.45

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
SCHEMBL5564856 1.00 ACE (0.45) ACEMME
SCHEMBL5563609 0.91 DRD2 (0.41) ACEMME
SCHEMBL5563656 0.88 MC4R (0.41) ACEMME
SCHEMBL7668349 0.88 MC4R (0.42) ACE
SCHEMBL5563362 0.88 MC4R (0.42) ACE
SCHEMBL5377148 0.84 ACE (0.60) ACEMME
SCHEMBL5563795 0.84 TSHR (0.44) —
SCHEMBL5563800 0.84 TSHR (0.44) —
2,2,2-Trifluoroethanaminium SCHEMBL8213280 0.82 SCN9A (0.40) —
Trifluoroacetamide SCHEMBL8213276 0.82 SCN9A (0.40) ACE

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