SCHEMBL13290847

SCHEMBL13290847

CNCCCC[C@@H](NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H](N)Cc1ccccc1)C(=O)N1CCCNCC1

nearest known ligand 0.74

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ OPRK1 P41145 20/20 0.74
▸ OPRM1 P35372 2/20 0.52

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
SCHEMBL11932327 0.98 OPRK1 (0.70) OPRK1OPRM1
SCHEMBL18413115 0.94 OPRK1 (0.75) OPRK1OPRM1
SCHEMBL20363368 0.92 OPRK1 (0.63) OPRK1OPRM1
SCHEMBL17132155 0.92 OPRK1 (0.73) OPRK1OPRM1
SCHEMBL11931470 0.91 OPRK1 (0.72) OPRK1OPRM1
SCHEMBL11931972 0.91 OPRK1 (0.69) OPRK1OPRM1
SCHEMBL10316466 0.89 OPRK1 (0.60) OPRK1
SCHEMBL10316438 0.88 OPRK1 (0.74) OPRK1OPRM1
SCHEMBL21286632 0.88 OPRK1 (0.74) OPRK1OPRM1
SCHEMBL19249834 0.88 OPRK1 (0.74) 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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