SCHEMBL701427

SCHEMBL701427

CC(C)(C)OC(=O)N1CCC(CCCN2CCCC2)(c2cccc(Cl)c2)CC1

nearest known ligand 0.55

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CCR5 P51681 9/20 0.55
TACR1 P25103 1/20 0.44
DRD2 P14416 3/20 0.43
STS P08842 1/20 0.42
HRH3 Q9Y5N1 3/20 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
SCHEMBL702431 0.88 CCR5 (0.55) CCR5TACR1
SCHEMBL702500 0.88 CCR5 (0.55) CCR5TACR1STS
SCHEMBL10246597 0.87 TACR1 (0.54) CCR5TACR1
SCHEMBL700173 0.83 CCR5 (0.54) CCR5TACR1STS
SCHEMBL702385 0.83 CCR5 (0.51) CCR5TACR1STS
SCHEMBL700251 0.82 CCR5 (0.57) CCR5TACR1
SCHEMBL4304988 0.82 CCR5 (0.45) CCR5TACR1STSHRH3
SCHEMBL10282911 0.82 CCR5 (0.58) CCR5TACR1
SCHEMBL4414050 0.81 CCR5 (0.53) CCR5TACR1STS
SCHEMBL3525135 0.81 CCR5 (0.54) CCR5TACR1STS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8124624-B2 Substituted sulfonamide compounds GRUENENTHAL GMBH (DE) 2012-02-28 US disclosed
US-8124624-B2 Substituted sulfonamide compounds GRUENENTHAL GMBH (DE) 2012-02-28 US disclosed
US-8124624-B2 Substituted sulfonamide compounds GRUENENTHAL GMBH (DE) 2012-02-28 US disclosed
EP-2262791-A2 SUBSTITUTED SULFONAMIDE DERIVATIVES Grünenthal GmbH (DE) 2010-12-22 EP disclosed
US-20090264407-A1 Substituted Sulfonamide Compounds GRUENENTHAL GMBH (DE) 2009-10-22 US disclosed
US-20090264407-A1 Substituted Sulfonamide Compounds GRUENENTHAL GMBH (DE) 2009-10-22 US disclosed
US-20090264407-A1 Substituted Sulfonamide Compounds GRUENENTHAL GMBH (DE) 2009-10-22 US disclosed
WO-2009124734-A2 SUBSTITUTED SULFONAMIDE DERIVATIVES Grünenthal GmbH (DE) 2009-10-15 WO 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-20090264407-A1 Substituted Sulfonamide Compounds CNR1, SUCNR1, OPRL1 CCR5 1218/4885TACR1 18/4885DRD2 1900/4885

“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.