SCHEMBL17284751

SCHEMBL17284751

C=CCN1CC[C@@]23c4c5ccc(OC)c4O[C@@H]2C(=C)CC[C@@H]3[C@@H]1C5

nearest known ligand 0.61

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
OPRD1 P41143 12/20 0.61
OPRM1 P35372 11/20 0.61
OPRK1 P41145 8/20 0.61
LMNA P02545 1/20 0.61
PDE4D Q08499 1/20 0.61
MRGPRX2 Q96LB1 1/20 0.61
SIGMAR1 Q99720 1/20 0.45

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
SCHEMBL18457621 1.00 OPRD1 (0.61) OPRD1OPRM1OPRK1LMNAPDE4D
SCHEMBL12960789 1.00 OPRD1 (0.61) OPRD1OPRM1OPRK1LMNAPDE4D
SCHEMBL12646312 1.00 OPRD1 (0.61) OPRD1OPRM1OPRK1LMNAPDE4D
SCHEMBL22058979 1.00 OPRD1 (0.61) OPRD1OPRM1OPRK1LMNAPDE4D
SCHEMBL18473479 1.00 OPRD1 (0.61) OPRD1OPRM1OPRK1LMNAPDE4D
SCHEMBL11372759 0.90 OPRM1 (0.77) OPRD1OPRM1OPRK1LMNAPDE4D
SCHEMBL11269078 0.90 OPRM1 (0.77) OPRD1OPRM1OPRK1LMNAPDE4D
SCHEMBL12013633 0.90 OPRM1 (0.77) OPRD1OPRM1OPRK1LMNAPDE4D
SCHEMBL12588836 0.89 OPRM1 (0.47) OPRD1OPRM1OPRK1LMNAPDE4D
SCHEMBL22058865 0.83 OPRD1 (0.56) OPRD1OPRM1OPRK1LMNAPDE4D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10363251-B2 (+)-morphinans as antagonists of toll-like receptor 9 and therapeutic uses thereof MALLINCKRODT LLC (US) 2019-07-30 US disclosed
US-9562014-B2 (+)-morphinans as antagonists of toll-like receptor 9 and therapeutic uses thereof MALLINCKRODT LLC (US) 2017-02-07 US disclosed
US-20170029432-A1 (+)-MORPHINANS AS ANTAGONISTS OF TOLL-LIKE RECEPTOR 9 AND THERAPEUTIC USES THEREOF MALLINCKRODT ENTERPRISES LLC 2017-02-02 US disclosed
US-20150335638-A1 (+)-MORPHINANS AS ANTAGONISTS OF TOLL-LIKE RECEPTOR 9 AND THERAPEUTIC USES THEREOF STRATATECH CORPORATION 2015-11-26 US 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-20170029432-A1 (+)-MORPHINANS AS ANTAGONISTS OF TOLL-LIKE RECEPTOR 9 AND THERAPEUTIC USES THEREOF TLR9, TLR3, TLR7 OPRD1 13/4885OPRM1 5/4885OPRK1 11/4885
US-10363251-B2 (+)-morphinans as antagonists of toll-like receptor 9 and therapeutic uses thereof TLR9, TLR3, TLR7 OPRD1 141/4885OPRM1 30/4885OPRK1 101/4885
US-20150335638-A1 (+)-MORPHINANS AS ANTAGONISTS OF TOLL-LIKE RECEPTOR 9 AND THERAPEUTIC USES THEREOF TLR9, TLR3, TLR7 OPRD1 141/4885OPRM1 30/4885OPRK1 101/4885

“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.