SCHEMBL3298442

SCHEMBL3298442

Cc1c(Cl)cccc1S(=O)(=O)Nc1nc2scnc2nc1OCc1ccc2c(c1)OCCN2C

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 1/20 0.46
▸ SCN9A Q15858 2/20 0.39
▸ CCR4 P51679 3/20 0.38
▸ LMNA P02545 1/20 0.37
▸ THRB P10828 1/20 0.37
▸ PTGES2 Q9H7Z7 1/20 0.36
▸ HSD11B1 P28845 3/20 0.36
▸ HSD17B1 P14061 1/20 0.36
▸ HSD17B2 P37059 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.35

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
SCHEMBL3295686 0.98 TP53 (0.46) TP53SCN9ACCR4LMNATHRB
SCHEMBL3294179 0.95 TP53 (0.44) TP53SCN9ACCR4LMNATHRB
SCHEMBL3290878 0.93 TP53 (0.45) TP53SCN9ACCR4LMNATHRB
SCHEMBL3298219 0.89 TP53 (0.46) TP53SCN9ACCR4LMNATHRB
SCHEMBL3294720 0.88 TP53 (0.46) TP53SCN9ACCR4LMNATHRB
SCHEMBL3293120 0.87 TP53 (0.49) TP53SCN9ACCR4LMNATHRB
SCHEMBL3297148 0.86 TP53 (0.46) TP53SCN9ACCR4LMNATHRB
SCHEMBL3293263 0.86 TP53 (0.49) TP53SCN9ACCR4LMNATHRB
SCHEMBL3292707 0.86 TP53 (0.47) TP53SCN9ACCR4LMNATHRB
SCHEMBL3291427 0.85 TP53 (0.48) TP53SCN9ACCR4LMNATHRB

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 TP53 2581/4885SCN9A 2485/4885CCR4 2/4885
US-20070254886-A1 Chemokine Receptor Antagonist and Medical Use Thereof CCR5, CCR4, CCR1 TP53 2581/4885SCN9A 2485/4885CCR4 2/4885

“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.

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