SCHEMBL27483470

SCHEMBL27483470

O[C@H]1C=C[C@H]2[C@H]3Cc4ccc(OCc5ccccc5)c5c4[C@@]2(CCN3Cc2ccccc2)[C@H]1O5

nearest known ligand 0.64

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ OPRM1 P35372 5/20 0.60
▸ OPRK1 P41145 4/20 0.60
▸ OPRD1 P41143 4/20 0.60
▸ MRGPRX2 Q96LB1 2/20 0.60
▸ ADRB1 P08588 1/20 0.60
▸ PDE4D Q08499 1/20 0.60
▸ PDE3A Q14432 1/20 0.60
▸ SIGMAR1 Q99720 1/20 0.55
▸ SLC18A3 Q16572 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
SCHEMBL29359245 0.89 OPRD1 (0.74) OPRM1OPRK1OPRD1MRGPRX2ADRB1
SCHEMBL1278380 0.89 OPRD1 (0.74) OPRM1OPRK1OPRD1MRGPRX2ADRB1
SCHEMBL24880 0.89 OPRD1 (0.74) OPRM1OPRK1OPRD1MRGPRX2ADRB1
SCHEMBL678993 0.89 OPRD1 (0.74) OPRM1OPRK1OPRD1MRGPRX2ADRB1
SCHEMBL15249248 0.89 OPRD1 (0.74) OPRM1OPRK1OPRD1MRGPRX2ADRB1
Hydrochloric Acid SCHEMBL31058090 0.88 OPRD1 (0.73) OPRM1OPRK1OPRD1MRGPRX2ADRB1
SCHEMBL16866229 0.85 OPRM1 (0.66) OPRM1OPRK1OPRD1MRGPRX2ADRB1
Propionic Acid SCHEMBL28993771 0.84 OPRD1 (0.67) OPRM1OPRK1OPRD1MRGPRX2ADRB1
SCHEMBL14033252 0.84 OPRD1 (0.60) OPRM1OPRK1OPRD1MRGPRX2ADRB1
SCHEMBL23673341 0.80 OPRD1 (0.71) OPRM1OPRK1OPRD1MRGPRX2ADRB1

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
CN-1152880-C Process for preparation of oxymorphone, oxycodone and derivatives — 2004-06-09 — — CN disclosed
CN-1272845-A Process for preparation of oxymorphone, oxycodone and derivatives PENICK CORP (US) 2000-11-08 — — CN disclosed
Send feedback