SCHEMBL3294138

SCHEMBL3294138

CN(C)CCOc1cc(COc2cc(Br)cnc2NS(=O)(=O)c2ccccc2Cl)ccc1Cl

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CCR4 P51679 7/20 0.46
UTS2R Q9UKP6 2/20 0.40
PTGDR2 Q9Y5Y4 7/20 0.40
EDNRA P25101 1/20 0.38
MEN1 O00255 1/20 0.36
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
MAPT P10636 1/20 0.36
HTT P42858 1/20 0.36
KMT2A Q03164 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
SCHEMBL3294730 0.93 CCR4 (0.52) CCR4
SCHEMBL3294221 0.90 PTGDR2 (0.45) CCR4UTS2RPTGDR2
SCHEMBL3294294 0.87 CCR4 (0.41) CCR4UTS2RPTGDR2ALDH1A1
SCHEMBL3294696 0.86 CCR4 (0.62) CCR4UTS2RMEN1ALDH1A1LMNA
SCHEMBL3290530 0.82 CCR4 (0.46) CCR4PTGDR2MEN1ALDH1A1LMNA
SCHEMBL3299685 0.80 CCR4 (0.40) CCR4UTS2RPTGDR2ALDH1A1
SCHEMBL3298419 0.80 CCR4 (0.49) CCR4
SCHEMBL3293844 0.80 CCR4 (0.45) CCR4UTS2RPTGDR2LMNA
SCHEMBL3291916 0.80 CCR4 (0.42) CCR4UTS2RPTGDR2EDNRA
SCHEMBL3294492 0.79 SLC40A1 (0.43) CCR4PTGDR2EDNRAMAPT

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-20100266539-A1 CHEMOKINE RECEPTOR ANTAGONIST AND MEDICAL USE THEREOF ONO PHARMACEUTICAL CO., LTD. (JP) 2010-10-21 US disclosed
US-7732442-B2 Chemokine receptor antagonist and medical use thereof ONO PHARMACEUTICAL CO., LTD. (JP) 2010-06-08 US disclosed
US-20070254886-A1 Chemokine Receptor Antagonist and Medical Use Thereof ONO PHARMACEUTICAL CO., LTD. (JP) 2007-11-01 US disclosed
EP-1661889-A1 CHEMOKINE RECEPTOR ANTAGONIST AND MEDICAL USE THEREOF ONO PHARMACEUTICAL CO., LTD. (JP) 2006-05-31 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-20100266539-A1 CHEMOKINE RECEPTOR ANTAGONIST AND MEDICAL USE THEREOF CCR5, CCR4, CCR1 CCR4 2/4885UTS2R 224/4885PTGDR2 681/4885
US-20070254886-A1 Chemokine Receptor Antagonist and Medical Use Thereof CCR5, CCR4, CCR1 CCR4 2/4885UTS2R 224/4885PTGDR2 681/4885

“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.