SCHEMBL13290853

SCHEMBL13290853

CNCCCC[C@@H](NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H](N)Cc1ccccc1)C(=O)N1CCC(N)(C(C)=O)CC1

nearest known ligand 0.91

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ OPRK1 P41145 20/20 0.91
▸ OPRM1 P35372 3/20 0.64

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
SCHEMBL10316439 0.95 OPRK1 (1.00) OPRK1OPRM1
SCHEMBL18413105 0.94 OPRK1 (0.98) OPRK1OPRM1
SCHEMBL13290873 0.93 OPRK1 (0.91) OPRK1OPRM1
SCHEMBL13290851 0.92 OPRK1 (0.91) OPRK1OPRM1
SCHEMBL24360695 0.91 OPRK1 (0.84) OPRK1OPRM1
SCHEMBL13290872 0.91 OPRK1 (0.76) OPRK1OPRM1
SCHEMBL20784131 0.90 OPRK1 (0.88) OPRK1OPRM1
SCHEMBL10316435 0.88 OPRK1 (1.00) OPRK1OPRM1
SCHEMBL21219312 0.88 OPRK1 (0.88) OPRK1OPRM1
SCHEMBL21219324 0.88 OPRK1 (0.90) OPRK1OPRM1

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
US-7727963-B2 Synthetic peptide amides CARA THERAPEUTICS, INC. (US) 2010-06-01 — — US disclosed
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