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Sugi Predict / Compounds / Oxycodone

Oxycodone

Oxycodone

SCHEMBL17165053

CN1CC[C@]23c4c5ccc(O)c4O[C@H]2[C@@H](O)C=C[C@H]3[C@H]1C5.COc1ccc2c3c1O[C@H]1C(=O)CC[C@@]4(O)[C@@H](C2)N(C)CC[C@]314.COc1ccc2c3c1O[C@H]1C(=O)CC[C@H]4[C@@H](C2)N(C)CC[C@]314

nearest known ligand 0.61

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

OPRM1

The experimentally established mechanism targets of Oxycodone. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ OPRM1 known ✓ P35372 13/20 0.61
▸ OPRD1 P41143 10/20 0.61
▸ OPRK1 P41145 10/20 0.61
▸ MRGPRX2 Q96LB1 5/20 0.60
▸ PDE4D Q08499 2/20 0.60
▸ LMNA P02545 1/20 0.60
▸ ADRB1 P08588 1/20 0.59
▸ PDE3A Q14432 1/20 0.59
▸ 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.

Compoundsimilaritytop predictedshared targets
Oxycodone SCHEMBL19285728 1.00 OPRM1 (0.61) OPRM1OPRD1OPRK1MRGPRX2PDE4D
Oxycodone SCHEMBL19463262 0.98 OPRM1 (0.59) OPRM1OPRD1OPRK1MRGPRX2PDE4D
Oxycodone SCHEMBL7570264 0.97 OPRM1 (0.65) OPRM1OPRD1OPRK1MRGPRX2PDE4D
Oxymorphone SCHEMBL1828172 0.95 OPRM1 (0.68) OPRM1OPRD1OPRK1MRGPRX2PDE4D
Oxycodone SCHEMBL1029465 0.95 OPRM1 (0.68) OPRM1OPRD1OPRK1MRGPRX2PDE4D
Oxycodone SCHEMBL4588570 0.92 OPRM1 (0.73) OPRM1OPRD1OPRK1MRGPRX2PDE4D
Oxycodone SCHEMBL3407528 0.92 OPRM1 (0.73) OPRM1OPRD1OPRK1MRGPRX2PDE4D
Codeine SCHEMBL250022 0.91 OPRM1 (0.72) OPRM1OPRD1OPRK1MRGPRX2PDE4D
Codeine SCHEMBL3239478 0.91 OPRM1 (0.72) OPRM1OPRD1OPRK1MRGPRX2PDE4D
Oxycodone SCHEMBL19285721 0.90 OPRM1 (0.57) OPRM1OPRD1OPRK1MRGPRX2PDE4D

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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3129383-A1 O-DEMETHYLATING PROCESS OF METHOXY SUBSTITUTED MORPHINAN-6-ONE DERIVATIVES CILAG AG (CH) 2017-02-15 — — EP disclosed
WO-2015155181-A1 O-DEMETHYLATING PROCESS OF METHOXY SUBSTITUTED MORPHINAN-6-ONE DERIVATIVES CILAG AG (CH) 2015-10-15 — — WO disclosed