SCHEMBL6653871

SCHEMBL6653871

CCCCCCN1CCC(C)(c2cc(NS(C)(=O)=O)ccc2Cl)C(C)C1

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 1/20 0.42
STS P08842 1/20 0.39
OPRM1 P35372 5/20 0.38
OPRD1 P41143 2/20 0.37
GAA P10253 1/20 0.37
HPGD P15428 1/20 0.37
MAPK1 P28482 1/20 0.37
OPRK1 P41145 1/20 0.36
KCNH2 Q12809 1/20 0.36

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
SCHEMBL6653869 1.00 SIGMAR1 (0.42) SIGMAR1STSOPRM1OPRD1GAA
SCHEMBL6661553 0.86 OPRM1 (0.34) SIGMAR1OPRM1OPRD1OPRK1
SCHEMBL6661547 0.86 OPRM1 (0.34) SIGMAR1OPRM1OPRD1OPRK1
SCHEMBL6654085 0.84 OPRM1 (0.41) OPRM1OPRD1OPRK1
SCHEMBL6654080 0.84 OPRM1 (0.41) OPRM1OPRD1OPRK1
SCHEMBL6653130 0.83 OPRM1 (0.52) OPRM1OPRD1OPRK1KCNH2
SCHEMBL6653132 0.83 OPRM1 (0.52) OPRM1OPRD1OPRK1KCNH2
Hydrochloric Acid SCHEMBL6657745 0.83 OPRM1 (0.52) OPRM1OPRD1OPRK1KCNH2
Hydrochloric Acid SCHEMBL6657743 0.83 OPRM1 (0.52) OPRM1OPRD1OPRK1KCNH2
SCHEMBL7648038 0.82 OPRM1 (0.53) SIGMAR1OPRM1OPRD1OPRK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1077940-B1 4-PHENYLPIPERIDINES FOR THE TREATMENT OF PRURITIC DERMATOSES PFIZER (US) 2004-07-14 EP disclosed
US-6610711-B2 4-phenylpiperidines for the treatment of pruritic dermatoses PFIZER INC. 2003-08-26 US disclosed
US-20030078282-A1 Novel 4-phenylpiperidines for the treatment of pruritic dermatoses PFIZER INC. 2003-04-24 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-20030078282-A1 Novel 4-phenylpiperidines for the treatment of pruritic dermatoses HRH2, HRH4, HRH1 SIGMAR1 629/4885STS 4179/4885OPRM1 409/4885

“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.