SCHEMBL13290886

SCHEMBL13290886

CC(=N)N1CCCN(C(=O)[C@@H](CCCCN)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](N)Cc2ccccc2)CC1

nearest known ligand 0.74

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ OPRK1 P41145 20/20 0.74
▸ OPRM1 P35372 3/20 0.61

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
SCHEMBL10316473 0.94 OPRK1 (0.73) OPRK1OPRM1
SCHEMBL13290912 0.94 OPRK1 (0.69) OPRK1OPRM1
SCHEMBL13290892 0.92 OPRK1 (0.76) OPRK1OPRM1
SCHEMBL11931971 0.92 OPRK1 (0.69) OPRK1OPRM1
SCHEMBL17132202 0.91 OPRK1 (0.73) OPRK1OPRM1
SCHEMBL13290888 0.91 OPRK1 (0.65) OPRK1
SCHEMBL13290918 0.90 OPRK1 (0.62) OPRK1
SCHEMBL24001220 0.89 OPRK1 (0.75) OPRK1OPRM1
SCHEMBL22962406 0.88 OPRK1 (0.77) OPRK1OPRM1
SCHEMBL22962321 0.88 OPRK1 (0.77) 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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