SCHEMBL11568587

SCHEMBL11568587

C[C@@H]1CC(=S)[C@@H](C(N)=O)N1C(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCC(=O)N1

nearest known ligand 0.47

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ TRHR P34981 6/20 0.46

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
SCHEMBL7414924 0.85 TRHR (0.51) TRHR
SCHEMBL7413925 0.81 TRHR (0.49) TRHR
SCHEMBL1370285 0.80 TRHR (0.52) TRHR
SCHEMBL27869228 0.79 TRHR (0.46) TRHR
SCHEMBL29405912 0.79 TRHR (0.46) TRHR
SCHEMBL6026783 0.79 TRHR (0.46) TRHR
SCHEMBL6026780 0.79 TRHR (0.46) TRHR
SCHEMBL11569073 0.78 TRHR (0.39) TRHR
Protirelin SCHEMBL14280929 0.78 TRHR (0.71) TRHR
Protirelin SCHEMBL20659679 0.78 TRHR (0.71) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0001845-A2 Analeptic tripeptides, process for their preparation and pharmaceutical composition containing the same MERCK & CO. INC. (US) 1979-05-16 — — EP disclosed
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