SCHEMBL7333406

SCHEMBL7333406

C[C@@H]1CC(=O)N[C@@H]1C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N1CSCC1C(N)=O

nearest known ligand 0.41

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ TRHR P34981 6/20 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
SCHEMBL7327791 1.00 TRHR (0.41) TRHR
SCHEMBL7271918 0.89 TRHR (0.45) TRHR
SCHEMBL7377796 0.86 TRHR (0.37) TRHR
SCHEMBL7326652 0.85 TRHR (0.56) TRHR
SCHEMBL7334062 0.85 TRHR (0.56) TRHR
SCHEMBL7332570 0.83 TRHR (0.40) TRHR
SCHEMBL7326005 0.83 TRHR (0.41) TRHR
SCHEMBL9571152 0.82 TRHR (0.59) TRHR
SCHEMBL7359544 0.82 TRHR (0.41) TRHR
SCHEMBL7273365 0.82 ACE (0.34) 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-0384380-A2 Novel peptide derivatives and their pharmaceutical use JAPAN TOBACCO INC. (JP) 1990-08-29 — — EP claimed
EP-0384380-B1 Novel peptide derivatives and their pharmaceutical use JAPAN TOBACCO INC (JP) 1996-06-19 — — EP disclosed
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