SCHEMBL7775338

SCHEMBL7775338

NCC(=O)N1C(c2ccccc2)CC[C@H]1C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ FFAR2 O15552 3/20 0.48
▸ ACE P12821 3/20 0.47
▸ MME P08473 2/20 0.47

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
SCHEMBL7775333 1.00 FFAR2 (0.48) FFAR2ACEMME
SCHEMBL8869991 1.00 FFAR2 (0.48) FFAR2ACEMME
SCHEMBL8871926 0.91 KMT2A (0.43) FFAR2ACEMME
SCHEMBL8870279 0.89 RIPK1 (0.43) —
SCHEMBL8870271 0.89 RIPK1 (0.43) —
SCHEMBL7773381 0.88 ACE (0.46) ACEMME
SCHEMBL7773384 0.88 ACE (0.46) ACEMME
SCHEMBL7775295 0.86 MME (0.58) FFAR2ACEMME
SCHEMBL7775293 0.86 MME (0.58) FFAR2ACEMME
SCHEMBL2042474 0.84 ALDH1A1 (0.52) FFAR2ACEMME

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-0723974-B1 Derivatives of mercaptoalkanoyldipeptides, their preparation and pharmaceutical compositions containing them ADIR (FR) 2001-08-16 — — EP disclosed
US-5610144-A CHOLECYSTOKININ OR GASTRIN ANTAGONISTS; NERVOUS SYSTEM AND GASTROINTESTINAL DISORDERS RHONE-POULENC RORER S.A. (FR) 1997-03-11 — — US disclosed
CN-1137040-A New mercaptoalanoyldipeptide compounds process for their preparation and pharmaceutical compositions containign them ADIR (FR) 1996-12-04 — — CN disclosed
EP-0723974-A1 Derivatives of mercaptoalkanoyldipeptides, their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1996-07-31 — — EP disclosed
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