SCHEMBL3757692

SCHEMBL3757692

C[C@H]1CN(CC(Cc2ccccc2)C(=O)OC(C)(C)C)CC[C@@]1(C)c1cccc(O)c1

nearest known ligand 0.79

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 14/20 0.79
OPRD1 P41143 14/20 0.79
OPRK1 P41145 11/20 0.71
KCNE1 P15382 1/20 0.71
KCNQ1 P51787 1/20 0.71
CACNA1C Q13936 1/20 0.71

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
SCHEMBL3757695 1.00 OPRM1 (0.79) OPRM1OPRD1OPRK1KCNE1KCNQ1
SCHEMBL3766849 0.91 OPRM1 (0.64) OPRM1OPRD1OPRK1KCNE1KCNQ1
SCHEMBL3766847 0.91 OPRM1 (0.64) OPRM1OPRD1OPRK1KCNE1KCNQ1
SCHEMBL3766852 0.91 OPRM1 (0.64) OPRM1OPRD1OPRK1KCNE1KCNQ1
SCHEMBL14993654 0.90 OPRM1 (0.83) OPRM1OPRD1OPRK1KCNE1KCNQ1
SCHEMBL1706299 0.90 OPRM1 (0.83) OPRM1OPRD1OPRK1KCNE1KCNQ1
SCHEMBL14653019 0.90 OPRM1 (0.83) OPRM1OPRD1OPRK1KCNE1KCNQ1
SCHEMBL3765655 0.90 OPRM1 (0.83) OPRM1OPRD1OPRK1KCNE1KCNQ1
SCHEMBL16449953 0.90 OPRM1 (0.83) OPRM1OPRD1OPRK1KCNE1KCNQ1
SCHEMBL14653018 0.90 OPRM1 (0.83) OPRM1OPRD1OPRK1KCNE1KCNQ1

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-20100311782-A1 SUBSTITUTED PIPERIDINYLPROPANOIC ACID COMPOUNDS AND METHODS OF THEIR USE ADOLOR CORPORATION (US) 2010-12-09 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-20100311782-A1 SUBSTITUTED PIPERIDINYLPROPANOIC ACID COMPOUNDS AND METHODS OF THEIR USE OPRK1, OPRM1, OPRL1 OPRM1 2/4885OPRD1 4/4885OPRK1 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.