SCHEMBL17438720

SCHEMBL17438720

COC(C)(C)CC(=O)N1CCC2(CCC(c3ccccc3)(N(C)C)CC2)C1

nearest known ligand 0.69

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 19/20 0.69
OPRL1 P41146 16/20 0.69
OPRK1 P41145 1/20 0.42
HSD11B1 P28845 1/20 0.42

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
SCHEMBL17439150 0.90 OPRM1 (0.71) OPRM1OPRL1HSD11B1
SCHEMBL17438999 0.85 OPRM1 (0.67) OPRM1OPRL1
SCHEMBL17439088 0.84 OPRM1 (0.51) OPRM1OPRL1HSD11B1
SCHEMBL17439067 0.84 OPRM1 (0.61) OPRM1OPRL1OPRK1HSD11B1
SCHEMBL17438806 0.83 OPRM1 (0.77) OPRM1OPRL1
SCHEMBL17438875 0.82 OPRM1 (0.69) OPRM1OPRL1OPRK1
SCHEMBL17439109 0.82 OPRM1 (0.76) OPRM1OPRL1OPRK1HSD11B1
SCHEMBL17438976 0.81 OPRM1 (1.00) OPRM1OPRL1OPRK1HSD11B1
SCHEMBL17438955 0.81 OPRM1 (0.46) OPRM1OPRL1HSD11B1
SCHEMBL17438894 0.81 OPRM1 (0.61) OPRM1OPRL1OPRK1HSD11B1

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
US-10202345-B2 Substituted azaspiro(4.5)decane derivatives GRUENENTHAL GMBH (DE) 2019-02-12 US claimed
US-20160016903-A1 Substituted Azaspiro(4.5)Decane Derivatives GRUENENTHAL GMBH (DE) 2016-01-21 US claimed

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

For each of this compound's patents that has machine-readable text (2 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-10202345-B2 Substituted azaspiro(4.5)decane derivatives OPRL1, OPRD1, OPRM1 OPRM1 3/4885OPRL1 1/4885OPRK1 5/4885
US-20160016903-A1 Substituted Azaspiro(4.5)Decane Derivatives OPRL1, OPRD1, OPRM1 OPRM1 3/4885OPRL1 1/4885OPRK1 5/4885

“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.