SCHEMBL15501040

CN1CCC23c4c5ccc(OC(=O)c6cccc(C(=O)Oc7ccc8c9c7O[C@@H]7[C@H](O)C=CC%10[C@H](C8)N(C)CC[C@]9%107)c6)c4O[C@H]2[C@H](O)C=CC3[C@@H]1C5

nearest known ligand 0.73

Predicted protein targets (top 10)

	gene	UniProt	supporting neighbours	confidence
▸	OPRD1	P41143	7/20	0.73

▸	OPRM1	P35372	6/20	0.73

▸	OPRK1	P41145	4/20	0.73

▸	MRGPRX2	Q96LB1	4/20	0.73

▸	ADRB1	P08588	1/20	0.73

▸	PDE4D	Q08499	1/20	0.73

▸	PDE3A	Q14432	1/20	0.73

▸	SLC22A1	O15245	1/20	0.65

▸	ADRA2A	P08913	1/20	0.65

▸	ARRB1	P49407	1/20	0.65

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.

Compound	similarity	top predicted	shared targets
SCHEMBL12082085	1.00	OPRD1 (0.73)	OPRD1OPRM1OPRK1MRGPRX2ADRB1
SCHEMBL6459794	0.95	OPRD1 (0.77)	OPRD1OPRM1OPRK1MRGPRX2ADRB1
SCHEMBL28475957	0.94	OPRD1 (0.67)	OPRD1OPRM1OPRK1MRGPRX2ADRB1
SCHEMBL12082084	0.94	OPRD1 (0.76)	OPRD1OPRM1OPRK1MRGPRX2ADRB1
SCHEMBL12082094	0.93	OPRD1 (0.69)	OPRD1OPRM1OPRK1MRGPRX2ADRB1
SCHEMBL28470432	0.91	OPRD1 (0.63)	OPRD1OPRM1OPRK1MRGPRX2ADRB1
SCHEMBL12082398	0.91	OPRD1 (0.73)	OPRD1OPRM1OPRK1MRGPRX2ADRB1
SCHEMBL15702077	0.91	OPRD1 (0.71)	OPRD1OPRM1OPRK1MRGPRX2ADRB1
SCHEMBL12082393	0.90	OPRD1 (0.74)	OPRD1OPRM1OPRK1MRGPRX2ADRB1
SCHEMBL27496008	0.90	OPRD1 (0.66)	OPRD1OPRM1OPRK1MRGPRX2ADRB1

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.

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
EP-2376496-B1	SYNTHESIS OF MORPHINE-6-GLUCURONIDE OR OF A DERIVATIVE THEREOF	SANOFI SA (FR)	2014-03-12	—	—	EP	disclosed