SCHEMBL3294696

SCHEMBL3294696

Cc1ccc(S(=O)(=O)Nc2ncc(Br)cc2OCc2ccc(Cl)c(OCCN(C)C)c2)cc1

nearest known ligand 0.62

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CCR4 P51679 2/20 0.62
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
TDP1 Q9NUW8 1/20 0.41
MAPT P10636 3/20 0.40
ALDH1A1 P00352 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
LMNA P02545 2/20 0.37
XBP1 P17861 2/20 0.37
GAA P10253 1/20 0.37
POLB P06746 1/20 0.37
HPGD P15428 1/20 0.37
HTT P42858 1/20 0.37
UTS2R Q9UKP6 2/20 0.36
EDNRB P24530 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
SCHEMBL3293668 0.90 CCR4 (0.76) CCR4MEN1KMT2AMAPTALDH1A1
SCHEMBL3293897 0.87 CCR4 (0.56) CCR4MEN1KMT2ATDP1MAPT
SCHEMBL3294138 0.86 CCR4 (0.46) CCR4MEN1KMT2AMAPTALDH1A1
SCHEMBL3294730 0.85 CCR4 (0.52) CCR4
SCHEMBL3290843 0.83 CCR4 (0.71) CCR4MEN1KMT2ATDP1MAPT
SCHEMBL3294221 0.82 PTGDR2 (0.45) CCR4UTS2R
SCHEMBL3294737 0.80 CCR4 (0.41) CCR4MEN1KMT2ATDP1MAPT
SCHEMBL3298187 0.80 CCR4 (0.61) CCR4MEN1KMT2AMAPTALDH1A1
SCHEMBL3292977 0.80 CCR4 (0.60) CCR4MEN1KMT2ATDP1MAPT
SCHEMBL3292318 0.79 CCR4 (0.59) CCR4MEN1KMT2ATDP1MAPT

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 2/4885MEN1 3502/4885KMT2A 4641/4885
US-20070254886-A1 Chemokine Receptor Antagonist and Medical Use Thereof CCR5, CCR4, CCR1 CCR4 2/4885MEN1 3502/4885KMT2A 4641/4885

“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.