SCHEMBL14075147

SCHEMBL14075147

CCCCOc1ccc2c3c1O[C@H]1C(OC)(OC)CC[C@@](O)([C@H](N(C)CC4CC4)C2)C31C

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
OPRK1 P41145 9/20 0.33
OPRM1 P35372 7/20 0.33
OPRD1 P41143 5/20 0.33
ALDH1A1 P00352 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
TSHR P16473 1/20 0.32
HSD17B10 Q99714 1/20 0.32
HCRTR1 O43613 1/20 0.32
LMNA P02545 1/20 0.32
BLM P54132 1/20 0.32

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
SCHEMBL14075340 0.84 OPRM1 (0.42) OPRK1OPRM1OPRD1
SCHEMBL14075334 0.84 OPRK1 (0.34) OPRK1OPRM1OPRD1
SCHEMBL14075212 0.83 OPRK1 (0.34) OPRK1OPRM1OPRD1
SCHEMBL14075145 0.83 OPRM1 (0.39) OPRK1OPRM1OPRD1
SCHEMBL14075209 0.81 OPRM1 (0.41) OPRK1OPRM1OPRD1
SCHEMBL18162869 0.80 HCRTR1 (0.43) OPRK1OPRM1OPRD1ALDH1A1CYP3A4
SCHEMBL14075531 0.74 OPRM1 (0.57) OPRK1OPRM1OPRD1ALDH1A1CYP3A4
SCHEMBL13660036 0.74 OPRD1 (0.30) OPRK1OPRM1OPRD1
SCHEMBL14075329 0.73 OPRM1 (0.34) OPRK1OPRM1OPRD1
SCHEMBL18162960 0.72 OPRM1 (0.46) OPRK1OPRM1OPRD1ALDH1A1CYP3A4

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-20080234306-A1 N-Oxides of 4,5-Epoxy-Morphinanium Analogs PROGENICS PHARMACEUTICALS, INC. (US) 2008-09-25 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-20080234306-A1 N-Oxides of 4,5-Epoxy-Morphinanium Analogs OPRM1, OPRD1, OPRK1 OPRK1 3/4885OPRM1 1/4885OPRD1 2/4885

“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.