SCHEMBL24969706

SCHEMBL24969706

COc1cccc([C@]2(O)CCNC[C@H]2CN(C)C)c1

nearest known ligand 0.68

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
OPRD1 P41143 10/20 0.68
OPRK1 P41145 8/20 0.68
SLC6A2 P23975 6/20 0.68
SLC6A4 P31645 6/20 0.68
OPRM1 P35372 4/20 0.68
SLC22A1 O15245 2/20 0.68
CHRM2 P08172 1/20 0.68
CHRM1 P11229 1/20 0.68
MEN1 O00255 1/20 0.68
KMT2A Q03164 1/20 0.68

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
SCHEMBL24969242 1.00 OPRD1 (0.68) OPRD1OPRK1SLC6A2SLC6A4OPRM1
SCHEMBL24969483 1.00 OPRD1 (0.68) OPRD1OPRK1SLC6A2SLC6A4OPRM1
Hydrochloric Acid SCHEMBL30206730 0.99 OPRD1 (0.67) OPRD1OPRK1SLC6A2SLC6A4OPRM1
Hydrochloric Acid SCHEMBL28564704 0.99 OPRD1 (0.67) OPRD1OPRK1SLC6A2SLC6A4OPRM1
Hydrochloric Acid SCHEMBL28572513 0.99 OPRD1 (0.67) OPRD1OPRK1SLC6A2SLC6A4OPRM1
SCHEMBL22662432 0.81 OPRM1 (0.56) OPRD1OPRK1SLC6A2SLC6A4OPRM1
SCHEMBL20399445 0.81 OPRM1 (0.56) OPRD1OPRK1SLC6A2SLC6A4OPRM1
(R,R)-Tramadol SCHEMBL1593740 0.81 SLC6A2 (1.00) OPRD1OPRK1SLC6A2SLC6A4OPRM1
(R,R)-Tramadol SCHEMBL11984200 0.81 SLC6A2 (1.00) OPRD1OPRK1SLC6A2SLC6A4OPRM1
(R,R)-Tramadol SCHEMBL12831358 0.81 SLC6A2 (1.00) OPRD1OPRK1SLC6A2SLC6A4OPRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230027752-A1 OPIOID RECEPTOR AGONIST, PREPARATION METHOD THEREFOR AND PHARMACEUTICAL USE THEREOF FUDAN UNIVERSITY (CN) 2023-01-26 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 (1 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-20230027752-A1 OPIOID RECEPTOR AGONIST, PREPARATION METHOD THEREFOR AND PHARMACEUTICAL USE THEREOF OPRM1, OPRD1, OPRL1 OPRD1 2/4885OPRK1 4/4885SLC6A2 738/4885

“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.