Codeinone

Codeinone

SCHEMBL7707098

COc1ccc2c3c1O[C@H]1C(=O)C=C[C@H]4[C@@H](C2)N(C)CC[C@]314.[KH]

nearest known ligand 0.98

Full drug profile on Sugi Atlas →

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 14/20 0.98
OPRK1 P41145 9/20 0.68
OPRD1 P41143 5/20 0.68
MRGPRX2 Q96LB1 4/20 0.65
PDE4D Q08499 2/20 0.65
ADRB1 P08588 1/20 0.65
PDE3A Q14432 1/20 0.65
LMNA P02545 1/20 0.64

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
Codeinone SCHEMBL101725 0.99 OPRM1 (1.00) OPRM1OPRK1OPRD1MRGPRX2PDE4D
Codeinone SCHEMBL13154678 0.99 OPRM1 (1.00) OPRM1OPRK1OPRD1MRGPRX2PDE4D
Codeinone SCHEMBL13633530 0.99 OPRM1 (1.00) OPRM1OPRK1OPRD1MRGPRX2PDE4D
Codeinone SCHEMBL12137788 0.99 OPRM1 (1.00) OPRM1OPRK1OPRD1MRGPRX2PDE4D
Codeinone SCHEMBL100655 0.99 OPRM1 (1.00) OPRM1OPRK1OPRD1MRGPRX2PDE4D
Codeinone SCHEMBL14192923 0.99 OPRM1 (1.00) OPRM1OPRK1OPRD1MRGPRX2PDE4D
Codeinone SCHEMBL3107493 0.99 OPRM1 (1.00) OPRM1OPRK1OPRD1MRGPRX2PDE4D
Codeinone SCHEMBL29375985 0.99 OPRM1 (1.00) OPRM1OPRK1OPRD1MRGPRX2PDE4D
Codeinone SCHEMBL13952981 0.99 OPRM1 (1.00) OPRM1OPRK1OPRD1MRGPRX2PDE4D
Codeinone SCHEMBL11533410 0.94 OPRM1 (0.91) OPRM1OPRK1OPRD1MRGPRX2PDE4D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6365742-B1 THEBAINE AND (N-METHYL)ANALOGUES CONTAINING A DIENOL ESTER OR ETHER FROM MORPHOLINE, CODEINONE OR ANALOGUES HAVING AN ALPHA-BETA UNSATURATED KETONE VIA A NOVEL ALKOXYLATED INTERMEDIATE JOHNSON MATTHEY PUBLIC LIMITED COMPANY (GB) 2002-04-02 US disclosed
US-6090943-A Preparation of opiates, intermediates and uses of salts JOHNSON MATTHEY PUBLIC LIMITED COMPANY (GB) 2000-07-18 US disclosed
EP-0889045-A1 Process for the production of thebaine and analogues thereof, as well as intermediate products therefor JOHNSON MATTHEY PUBLIC LIMITED COMPANY (GB) 1999-01-07 EP disclosed