SCHEMBL10243104

SCHEMBL10243104

CN1CC[C@]23c4c5ccc(OC(=O)Oc6ccc([N+](=O)[O-])cc6)c4O[C@H]2C(O)C=CC3[C@H]1C5

nearest known ligand 0.65

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ OPRM1 P35372 7/20 0.65
▸ OPRD1 P41143 7/20 0.65
▸ OPRK1 P41145 5/20 0.65
▸ MRGPRX2 Q96LB1 4/20 0.65
▸ ADRB1 P08588 1/20 0.65
▸ PDE4D Q08499 1/20 0.65
▸ PDE3A Q14432 1/20 0.65
▸ SLC22A1 O15245 1/20 0.59
▸ ADRA2A P08913 1/20 0.59
▸ ARRB1 P49407 1/20 0.59

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
Codeine SCHEMBL4730550 0.90 OPRD1 (0.72) OPRM1OPRD1OPRK1MRGPRX2ADRB1
SCHEMBL12082104 0.89 OPRM1 (0.80) OPRM1OPRD1OPRK1MRGPRX2ADRB1
SCHEMBL14112546 0.86 OPRM1 (0.67) OPRM1OPRD1OPRK1MRGPRX2ADRB1
SCHEMBL28468334 0.86 OPRM1 (0.62) OPRM1OPRD1OPRK1MRGPRX2ADRB1
SCHEMBL6755526 0.85 OPRD1 (0.79) OPRM1OPRD1OPRK1MRGPRX2ADRB1
SCHEMBL28470432 0.85 OPRD1 (0.63) OPRM1OPRD1OPRK1MRGPRX2ADRB1
SCHEMBL29416620 0.84 OPRD1 (0.78) OPRM1OPRD1OPRK1MRGPRX2ADRB1
SCHEMBL547917 0.84 OPRD1 (0.78) OPRM1OPRD1OPRK1MRGPRX2ADRB1
SCHEMBL12195952 0.84 OPRM1 (0.74) OPRM1OPRD1OPRK1MRGPRX2ADRB1
SCHEMBL12195953 0.84 OPRM1 (0.74) 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 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150148284-A1 Controlled Release of Phenolic Opioids PHARMACOFORE, INC. 2015-05-28 — — US disclosed
US-8921418-B2 Controlled release of phenolic opioids SIGNATURE THERAPEUTICS, INC. (US) 2014-12-30 — — US disclosed
US-8921418-B2 Controlled release of phenolic opioids SIGNATURE THERAPEUTICS, INC. (US) 2014-12-30 — — US disclosed
EP-2046393-B1 CONTROLLED RELEASE OF PHENOLIC OPIOIDS SIGNATURE THERAPEUTICS INC (US) 2014-02-12 — — EP disclosed
US-20120270894-A1 Controlled Release of Phenolic Opioids 3I, LP 2012-10-25 — — US disclosed
US-20120270894-A1 Controlled Release of Phenolic Opioids 3I, LP 2012-10-25 — — US disclosed
US-8217005-B2 Controlled release of phenolic opioids SIGNATURE THERAPEUTICS, INC. (US) 2012-07-10 — — US disclosed
US-8217005-B2 Controlled release of phenolic opioids SIGNATURE THERAPEUTICS, INC. (US) 2012-07-10 — — US disclosed
EP-2402037-A1 Controlled release of phenolic opioids Pharmacofore, Inc. (US) 2012-01-04 — — EP disclosed
US-20100035826-A1 CONTROLLED RELEASE OF PHENOLIC OPIOIDS Phamacofoce, Inc. (CA) 2010-02-11 — — US disclosed
US-20100035826-A1 CONTROLLED RELEASE OF PHENOLIC OPIOIDS Phamacofoce, Inc. (CA) 2010-02-11 — — US disclosed
WO-2007140272-A2 CONTROLLED RELEASE OF PHENOLIC OPIOIDS PHARMACOFORE, INC. (US) 2007-12-06 — — WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120270894-A1 Controlled Release of Phenolic Opioids OPRK1, OPRM1, OPRD1 OPRM1 2/4885OPRD1 3/4885OPRK1 1/4885
US-20150148284-A1 Controlled Release of Phenolic Opioids OPRK1, OPRM1, OPRD1 OPRM1 2/4885OPRD1 3/4885OPRK1 1/4885
US-20100035826-A1 CONTROLLED RELEASE OF PHENOLIC OPIOIDS OPRK1, OPRM1, OPRD1 OPRM1 2/4885OPRD1 3/4885OPRK1 1/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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