SCHEMBL10072377

SCHEMBL10072377

CN(CC1CC1)C1Cc2ccc(C#N)c3c2C2(C)C(O3)C3(CCC12O)OCCO3

nearest known ligand 0.40

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 4/20 0.34
OPRK1 P41145 3/20 0.34
OPRD1 P41143 3/20 0.34
HCRTR1 O43613 1/20 0.31

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
SCHEMBL18162869 0.85 HCRTR1 (0.43) OPRM1OPRK1OPRD1HCRTR1
SCHEMBL10072376 0.84 OPRM1 (0.41) OPRM1OPRK1OPRD1
SCHEMBL14136326 0.80 OPRM1 (0.42) OPRM1OPRK1OPRD1
SCHEMBL10072368 0.76 OPRM1 (0.33) OPRM1OPRK1OPRD1HCRTR1
SCHEMBL14852724 0.75 HCRTR1 (0.43) OPRM1OPRK1OPRD1HCRTR1
SCHEMBL14075209 0.72 OPRM1 (0.41) OPRM1OPRK1OPRD1
SCHEMBL14075147 0.71 OPRK1 (0.33) OPRM1OPRK1OPRD1HCRTR1
SCHEMBL45975 0.71 OPRM1 (0.62) OPRM1OPRK1OPRD1
SCHEMBL20306845 0.71 OPRM1 (0.62) OPRM1OPRK1OPRD1
SCHEMBL20306877 0.71 OPRM1 (0.62) OPRM1OPRK1OPRD1

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-20120010412-A1 Process for the Synthesis of Substituted Morphinans ALKERMES, INC. (US) 2012-01-12 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-20120010412-A1 Process for the Synthesis of Substituted Morphinans CYP1B1, DHPS, CYP4B1 OPRM1 251/4885OPRK1 655/4885OPRD1 1176/4885

“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.