SCHEMBL11065582

SCHEMBL11065582

C[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(N)=O

nearest known ligand 0.68

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
OPRD1 P41143 7/20 0.67
OPRM1 P35372 7/20 0.67
OPRK1 P41145 1/20 0.67

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
SCHEMBL11059764 0.94 OPRD1 (0.68) OPRD1OPRM1OPRK1
SCHEMBL11069657 0.93 OPRD1 (0.65) OPRD1OPRM1OPRK1
SCHEMBL11065220 0.88 OPRM1 (0.66) OPRD1OPRM1
SCHEMBL29972771 0.88 OPRM1 (0.80) OPRD1OPRM1
SCHEMBL29973283 0.88 OPRM1 (0.80) OPRD1OPRM1
Acetic Acid SCHEMBL11329605 0.87 OPRD1 (0.69) OPRD1OPRM1
SCHEMBL30294044 0.87 OPRM1 (0.77) OPRD1OPRM1
Dermorphin SCHEMBL237169 0.87 OPRM1 (0.73) OPRD1OPRM1
Acetic Acid SCHEMBL11326955 0.87 OPRM1 (0.65) OPRD1OPRM1
SCHEMBL31303185 0.86 OPRM1 (0.78) OPRD1OPRM1

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-4465625-A ANALGESICS RICHTER GEDEON VEGYESZETI GYAR (HU) 1984-08-14 US disclosed