SCHEMBL6495481

SCHEMBL6495481

CCCCCCN1CCC(C)(c2cccc(CN)c2)C(C)C1

nearest known ligand 0.73

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 6/20 0.59
OPRD1 P41143 5/20 0.59
OPRK1 P41145 5/20 0.58

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
SCHEMBL6483854 0.89 OPRM1 (0.73) OPRM1OPRD1OPRK1
SCHEMBL6483610 0.87 OPRM1 (0.64) OPRM1OPRD1OPRK1
SCHEMBL6653158 0.87 OPRM1 (0.69) OPRM1OPRD1OPRK1
SCHEMBL6532475 0.87 OPRM1 (0.69) OPRM1OPRD1OPRK1
SCHEMBL6656424 0.84 OPRM1 (0.55) OPRM1OPRD1
SCHEMBL5899149 0.84 OPRM1 (0.73) OPRM1OPRD1OPRK1
SCHEMBL5899132 0.84 OPRM1 (0.73) OPRM1OPRD1OPRK1
SCHEMBL27276869 0.84 OPRM1 (0.73) OPRM1OPRD1OPRK1
SCHEMBL6656420 0.84 OPRM1 (0.55) OPRM1OPRD1
Hydrochloric Acid SCHEMBL9262175 0.83 OPRM1 (0.72) OPRM1OPRD1OPRK1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050085456-A1 Compounds useful in therapy PFIZER, INC. (US) 2005-04-21 US disclosed
US-6812236-B2 FOR THERAPY OF PRUTIUS PFIZER INC. 2004-11-02 US disclosed
US-20020099216-A1 Compounds useful in therapy PFIZER INC. 2002-07-25 US disclosed
EP-1072592-A2 4-arylpiperidine derivatives for the treatment of pruritus PFIZER INC. (US) 2001-01-31 EP 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-20050085456-A1 Compounds useful in therapy OPRL1, OPRD1, BDKRB1 OPRM1 5/4885OPRD1 2/4885OPRK1 9/4885
US-20020099216-A1 Compounds useful in therapy OPRD1, OPRL1, OPRM1 OPRM1 3/4885OPRD1 1/4885OPRK1 4/4885

“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.