SCHEMBL7272023

SCHEMBL7272023

C[C@H]1CC(=O)C[C@H]1C(=O)N[C@@H](CCC(=O)O)C(=O)N1CCC[C@H]1C(N)=O

nearest known ligand 0.43

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ ACE P12821 2/20 0.43
▸ REN P00797 1/20 0.43
▸ CMA1 P23946 3/20 0.41
▸ CTRC Q99895 2/20 0.41
▸ TRHR P34981 4/20 0.41

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
SCHEMBL7272027 0.93 TRHR (0.42) TRHR
SCHEMBL7273124 0.90 TRHR (0.44) TRHR
SCHEMBL7278905 0.88 TRHR (0.43) TRHR
SCHEMBL7282352 0.88 TRHR (0.43) TRHR
SCHEMBL7271987 0.87 TRHR (0.42) TRHR
SCHEMBL7273569 0.87 ACE (0.45) ACETRHR
SCHEMBL7271979 0.87 TRHR (0.42) TRHR
SCHEMBL7282638 0.87 TRHR (0.43) TRHR
SCHEMBL7273522 0.86 CAPN1 (0.44) TRHR
SCHEMBL7278785 0.84 EPHA2 (0.39) TRHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0473993-B1 Novel peptide derivatives and their pharmaceutical use JAPAN TOBACCO INC (JP) 1996-04-17 — — EP disclosed
EP-0473993-A2 Novel peptide derivatives and their pharmaceutical use Japan Tobacco Inc. (JP) 1992-03-11 — — EP disclosed
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