SCHEMBL4243399

SCHEMBL4243399

CC(CCN)N1CCC(N(Cc2cccc(Cl)c2)c2ccc([N+](=O)[O-])cc2)CC1

nearest known ligand 0.53

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CCR5 P51681 15/20 0.53
UBE2M P61081 4/20 0.43
DCUN1D1 Q96GG9 4/20 0.43
PGR P06401 1/20 0.42

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
SCHEMBL4239263 0.90 CCR5 (0.49) CCR5UBE2MDCUN1D1
SCHEMBL4242144 0.89 UBE2M (0.43) CCR5UBE2MDCUN1D1
SCHEMBL4235948 0.87 CCR5 (0.55) CCR5UBE2MDCUN1D1PGR
SCHEMBL4586726 0.84 CCR5 (0.46) CCR5UBE2MDCUN1D1PGR
SCHEMBL4247972 0.82 CCR5 (0.61) CCR5UBE2MDCUN1D1
SCHEMBL4241233 0.82 CCR5 (0.82) CCR5
SCHEMBL4247149 0.77 UBE2M (0.42) CCR5UBE2MDCUN1D1
SCHEMBL4249448 0.75 CCR5 (0.51) CCR5
SCHEMBL4236512 0.75 CCR5 (0.49) CCR5UBE2MDCUN1D1
SCHEMBL4240074 0.74 CCR5 (0.48) CCR5UBE2MDCUN1D1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7491735-B2 Chemokine receptor binding compounds GENZYME CORPORATION (US) 2009-02-17 US disclosed
EP-1708703-A4 CHEMOKINE RECEPTOR BINDING COMPOUNDS ANORMED INC (CA) 2008-04-09 EP disclosed
EP-1708703-A2 CHEMOKINE RECEPTOR BINDING COMPOUNDS ANORMED INC. (CA) 2006-10-11 EP disclosed
US-20050277670-A1 Chemokine receptor binding compounds ANORMED INC. 2005-12-15 US disclosed
WO-2005059107-A2 CHEMOKINE RECEPTOR BINDING COMPOUNDS ANORMED INC. (CA) 2005-06-30 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-20050277670-A1 Chemokine receptor binding compounds CCR5, CXCR3, CCL5 CCR5 1/4885UBE2M 4562/4885DCUN1D1 3581/4885

“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.