SCHEMBL4703145

SCHEMBL4703145

COc1nc(SC[C@H](NC(=O)OC(C)(C)C)C(=O)O)cnc1N(COCC[Si](C)(C)C)S(=O)(=O)c1cccc(Cl)c1Cl

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CCR4 P51679 14/20 0.34
MEN1 O00255 1/20 0.33
POLB P06746 1/20 0.33
KMT2A Q03164 1/20 0.33
PPARG P37231 5/20 0.33
PPARA Q07869 5/20 0.33
PPARD Q03181 2/20 0.32

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
SCHEMBL4704609 0.89 CCR4 (0.36) CCR4MEN1POLBKMT2APPARG
SCHEMBL4701929 0.88 CCR4 (0.36) CCR4MEN1POLBKMT2APPARG
SCHEMBL5907728 0.87 CCR4 (0.35) CCR4
SCHEMBL4700309 0.85 CCR4 (0.38) CCR4
SCHEMBL4703350 0.82 CCR4 (0.35) CCR4
SCHEMBL4705045 0.81 CCR4 (0.36) CCR4
SCHEMBL5907750 0.81 CCR4 (0.35) CCR4
SCHEMBL5744321 0.81 CCR4 (0.38) CCR4PPARGPPARAPPARD
SCHEMBL4704195 0.80 CCR4 (0.34) CCR4
SCHEMBL4703147 0.80 CCR4 (0.34) CCR4

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
EP-1633729-B1 SULPHONAMIDE COMPOUNDS THAT MODULATE CHEMOKINE RECEPTOR ACTIVITY (CCR4) ASTRAZENECA AB (SE) 2008-07-30 EP disclosed
EP-1583763-B1 BENZOAZOLYLPIPERAZINE DERIVATIVES HAVING VR1-ANTAGONIST ACTIVITY EURO CELTIQUE SA (LU) 2008-03-26 EP disclosed
US-20060122195-A1 Sulphonamide compounds that modulate chemokine receptor activity (ccr4) ASTRAZENECA AB (SE) 2006-06-08 US disclosed
EP-1633729-A1 SULPHONAMIDE COMPOUNDS THAT MODULATE CHEMOKINE RECEPTOR ACTIVITY (CCR4) AstraZeneca AB (SE) 2006-03-15 EP disclosed
WO-2004108692-A1 SULPHONAMIDE COMPOUNDS THAT MODULATE CHEMOKINE RECEPTOR ACTIVITY (CCR4) ASTRAZENECA AB (SE) 2004-12-16 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-20060122195-A1 Sulphonamide compounds that modulate chemokine receptor activity (ccr4) CCR4, CCR1, CCR3 CCR4 1/4885MEN1 4771/4885POLB 3924/4885

“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.