SCHEMBL2401720

SCHEMBL2401720

Cc1ccccc1S(=O)(=O)N[C@H]1CC[C@H](C(=O)N2CCN(C(C)C)CC2)CC1

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CCR8 P51685 7/20 0.52
ALDH1A1 P00352 3/20 0.45
HSD11B1 P28845 1/20 0.44
HRH2 P25021 1/20 0.44
HRH1 P35367 1/20 0.44
HRH3 Q9Y5N1 4/20 0.42
TSHR P16473 1/20 0.42
KCNH2 Q12809 1/20 0.40
CNR1 P21554 1/20 0.40
CNR2 P34972 1/20 0.40
DPP4 P27487 1/20 0.40
DPP7 Q9UHL4 1/20 0.40
SFRP1 Q8N474 1/20 0.40

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
SCHEMBL2401724 1.00 CCR8 (0.52) CCR8ALDH1A1HSD11B1HRH2HRH1
SCHEMBL2403258 0.89 ALDH1A1 (0.53) CCR8ALDH1A1HRH2HRH1HRH3
SCHEMBL2405226 0.89 ALDH1A1 (0.53) CCR8ALDH1A1HRH2HRH1HRH3
SCHEMBL2403265 0.89 ALDH1A1 (0.53) CCR8ALDH1A1HRH2HRH1HRH3
SCHEMBL2401728 0.88 DRD2 (0.48) CCR8ALDH1A1HSD11B1HRH2HRH1
SCHEMBL2401730 0.88 DRD2 (0.48) CCR8ALDH1A1HSD11B1HRH2HRH1
SCHEMBL2405887 0.86 CCR8 (0.53) CCR8ALDH1A1HSD11B1HRH2HRH1
SCHEMBL2405883 0.86 CCR8 (0.53) CCR8ALDH1A1HSD11B1HRH2HRH1
SCHEMBL2405892 0.85 USP30 (0.50) CCR8HSD11B1HRH3KCNH2DPP4
SCHEMBL2403253 0.85 ATM (0.53) CCR8ALDH1A1HRH2HRH1HRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8017773-B2 Cyclohexyl sulfonamide derivatives HOFFMANN-LA ROCHE INC. (US) 2011-09-13 US claimed
EP-1979322-B1 CYCLOHEXYL SULFONAMIDE DERIVATIVES HAVING H3 RECEPTOR ACTIVITY HOFFMANN LA ROCHE (CH) 2010-09-01 EP claimed
US-20100120791-A1 CYCLOHEXYL SULFONAMIDE DERIVATIVES NETTEKOVEN MATTHIAS 2010-05-13 US claimed
US-20070173511-A1 Cyclohexyl sulfonamide derivatives F. HOFFMANN-LA ROCHE AG (CH) 2007-07-26 US claimed
US-8017773-B2 Cyclohexyl sulfonamide derivatives HOFFMANN-LA ROCHE INC. (US) 2011-09-13 US disclosed
EP-1979322-B1 CYCLOHEXYL SULFONAMIDE DERIVATIVES HAVING H3 RECEPTOR ACTIVITY HOFFMANN LA ROCHE (CH) 2010-09-01 EP disclosed
US-20100120791-A1 CYCLOHEXYL SULFONAMIDE DERIVATIVES NETTEKOVEN MATTHIAS 2010-05-13 US disclosed
US-20070173511-A1 Cyclohexyl sulfonamide derivatives F. HOFFMANN-LA ROCHE AG (CH) 2007-07-26 US 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-20100120791-A1 CYCLOHEXYL SULFONAMIDE DERIVATIVES HRH3, HRH4, HRH1 CCR8 1481/4885ALDH1A1 430/4885HSD11B1 1268/4885
US-20070173511-A1 Cyclohexyl sulfonamide derivatives HRH3, HRH4, HRH1 CCR8 1481/4885ALDH1A1 430/4885HSD11B1 1268/4885

“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.