SCHEMBL19978231

SCHEMBL19978231

Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@@H]1CCNc2ccc(CN3CCCCCCCCCC3)cc21

nearest known ligand 0.77

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
OPRK1 P41145 19/20 0.77
OPRD1 P41143 1/20 0.72

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
SCHEMBL19969725 1.00 OPRK1 (0.77) OPRK1OPRD1
SCHEMBL19969926 0.93 OPRK1 (0.72) OPRK1OPRD1
SCHEMBL19969846 0.93 OPRK1 (0.72) OPRK1OPRD1
SCHEMBL19969848 0.92 OPRK1 (0.69) OPRK1OPRD1
SCHEMBL19969500 0.92 OPRK1 (0.69) OPRK1OPRD1
SCHEMBL19969925 0.92 OPRK1 (0.71) OPRK1OPRD1
SCHEMBL19969729 0.92 OPRK1 (0.71) OPRK1OPRD1
SCHEMBL19962707 0.91 OPRK1 (0.69) OPRK1OPRD1
SCHEMBL19969726 0.91 OPRK1 (0.69) OPRK1OPRD1
SCHEMBL19969499 0.89 OPRK1 (0.69) OPRK1OPRD1

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
WO-2018053240-A1 PEPTIDOMIMETICS AND METHODS OF USING THE SAME THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2018-03-22 WO disclosed