SCHEMBL7069840

SCHEMBL7069840

CCC1(c2cccc(NS(C)(=O)=O)c2)C2CN(Cc3ccccc3OCc3ccccc3)CC21

nearest known ligand 0.62

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 18/20 0.62
KCNH2 Q12809 3/20 0.58
OPRD1 P41143 2/20 0.56
OPRK1 P41145 2/20 0.56
MET P08581 1/20 0.41

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
SCHEMBL4698408 0.86 OPRM1 (0.74) OPRM1KCNH2OPRD1OPRK1
SCHEMBL5755436 0.80 OPRM1 (0.78) OPRM1KCNH2OPRD1OPRK1
SCHEMBL4703507 0.78 OPRM1 (0.63) OPRM1KCNH2OPRD1OPRK1
Acetic Acid SCHEMBL5754734 0.76 OPRM1 (0.72) OPRM1KCNH2OPRD1OPRK1
SCHEMBL7070109 0.75 KCNH2 (0.60) OPRM1KCNH2OPRD1OPRK1
SCHEMBL7074406 0.74 OPRM1 (0.67) OPRM1KCNH2OPRD1OPRK1
SCHEMBL5755126 0.74 OPRM1 (0.71) OPRM1KCNH2OPRD1OPRK1
SCHEMBL5755550 0.74 OPRM1 (0.78) OPRM1KCNH2OPRD1OPRK1
SCHEMBL5608182 0.74 KCNH2 (1.00) OPRM1KCNH2OPRD1OPRK1
SCHEMBL4699034 0.74 OPRM1 (0.57) OPRM1KCNH2OPRD1OPRK1

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-20030207876-A1 3-Azabicyclo[3.1.0]hexane derivatives useful in therapy PFIZER, INC. 2003-11-06 US disclosed
US-20020025948-A1 3-azabicyclo[3.1.0]hexane derivatives useful in therapy PFIZER INC. 2002-02-28 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 (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-20030207876-A1 3-Azabicyclo[3.1.0]hexane derivatives useful in therapy OPRD1, OPRK1, OPRM1 OPRM1 3/4885KCNH2 1279/4885OPRD1 1/4885
US-20020025948-A1 3-azabicyclo[3.1.0]hexane derivatives useful in therapy OPRD1, OPRK1, OPRM1 OPRM1 3/4885KCNH2 1279/4885OPRD1 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.