SCHEMBL27672335

COc1cc(C(=O)c2cc(OC)c3c4c2C[C@@H]2[C@@H]5C=C[C@H](O)[C@H](O3)[C@]45CCN2C)c2c3c1O[C@H]1[C@@H](O)C=C[C@H]4[C@@H](C2)N(C)CC[C@@]341

nearest known ligand 0.67

Predicted protein targets (top 10)

	gene	UniProt	supporting neighbours	confidence
▸	OPRM1	P35372	7/20	0.67

▸	OPRD1	P41143	7/20	0.67

▸	OPRK1	P41145	5/20	0.67

▸	MRGPRX2	Q96LB1	4/20	0.67

▸	ADRB1	P08588	1/20	0.67

▸	PDE4D	Q08499	1/20	0.67

▸	PDE3A	Q14432	1/20	0.67

▸	SLC22A1	O15245	1/20	0.55

▸	ADRA2A	P08913	1/20	0.55

▸	ARRB1	P49407	1/20	0.55

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
SCHEMBL2856631	0.95	OPRM1 (0.66)	OPRM1OPRD1OPRK1MRGPRX2ADRB1
SCHEMBL29360168	0.95	OPRM1 (0.66)	OPRM1OPRD1OPRK1MRGPRX2ADRB1
SCHEMBL27483132	0.91	OPRD1 (0.60)	OPRM1OPRD1OPRK1MRGPRX2ADRB1
SCHEMBL1662579	0.89	OPRM1 (0.69)	OPRM1OPRD1OPRK1MRGPRX2ADRB1
SCHEMBL11450667	0.89	OPRD1 (0.69)	OPRM1OPRD1OPRK1MRGPRX2ADRB1
SCHEMBL15738051	0.89	OPRM1 (0.69)	OPRM1OPRD1OPRK1MRGPRX2ADRB1
SCHEMBL16616437	0.88	OPRD1 (0.68)	OPRM1OPRD1OPRK1MRGPRX2ADRB1
SCHEMBL28136408	0.88	OPRD1 (0.68)	OPRM1OPRD1OPRK1MRGPRX2ADRB1
SCHEMBL15734327	0.88	OPRD1 (0.68)	OPRM1OPRD1OPRK1MRGPRX2ADRB1
SCHEMBL27868824	0.87	OPRD1 (0.66)	OPRM1OPRD1OPRK1MRGPRX2ADRB1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
CN-1918168-B	Methods for making 3-o-protected morphinones and 3-o-protected morphinone dienol carboxylates	EURO CELTIQUE SA	2011-04-27	—	—	CN	disclosed
CN-1918168-A	Methods for making 3-o-protected morphinones and 3-o-protected morphinone dienol carboxylates	EURO CELTIQUE SA (LU)	2007-02-21	—	—	CN	disclosed