SCHEMBL3132223

SCHEMBL3132223

O=C(O)c1cn(S(=O)(=O)c2ccc(Cl)cc2)c2ccc(Cl)cc12

nearest known ligand 0.58

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ AKR1C3 P42330 1/20 0.58
▸ AKR1C1 Q04828 1/20 0.58
▸ LMNA P02545 1/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.47
▸ HTR6 P50406 10/20 0.45
▸ ACLY P53396 2/20 0.45
▸ PLK1 P53350 1/20 0.44
▸ MEN1 O00255 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ KLK7 P49862 2/20 0.43
▸ CA2 P00918 1/20 0.42
▸ CA9 Q16790 1/20 0.42

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
SCHEMBL1466360 0.93 AKR1C3 (0.60) AKR1C3AKR1C1LMNASMN1; SMN2HTR6
SCHEMBL3146040 0.90 AKR1C3 (0.51) AKR1C3AKR1C1LMNASMN1; SMN2HTR6
SCHEMBL12748713 0.90 HTR6 (0.54) AKR1C3AKR1C1LMNASMN1; SMN2HTR6
SCHEMBL3132165 0.89 AKR1C3 (0.50) AKR1C3AKR1C1LMNASMN1; SMN2HTR6
SCHEMBL12748623 0.86 AKR1C3 (0.78) AKR1C3AKR1C1LMNASMN1; SMN2HTR6
SCHEMBL6769055 0.83 LMNA (0.71) AKR1C3AKR1C1LMNASMN1; SMN2HTR6
SCHEMBL3362896 0.80 HTR6 (0.44) HTR6KLK7CA2CA9
SCHEMBL1041051 0.80 LMNA (0.53) AKR1C3AKR1C1LMNASMN1; SMN2HTR6
SCHEMBL3137579 0.78 FLT1 (0.46) LMNASMN1; SMN2HTR6ACLYMEN1
SCHEMBL7135129 0.78 LMNA (0.48) AKR1C3AKR1C1LMNASMN1; SMN2HTR6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2118060-B1 1-BENZENESULFONYL-1H-INDOLE DERIVATIVES AS INHIBITORS OF CCR9 ACTIVITY NOVARTIS AG (CH) 2010-10-06 — — EP claimed
US-20100075963-A1 Pharmaceutically Active Benzensulphonyl-Indols NOVARTIS AG (CH) 2010-03-25 — — US claimed
CN-101605759-A 1-benzenesulfonyl-1H-indole derivatives as inhibitors of CCR9 activity NOVARTIS AG (CH) 2009-12-16 — — CN claimed
EP-2118060-A1 1-BENZENESULFONYL-1H-INDOLE DERIVATIVES AS INHIBITORS OF CCR9 ACTIVITY Novartis AG (CH) 2009-11-18 — — EP claimed
WO-2008095908-A1 1-BENZENESULFONYL-1H-INDOLE DERIVATIVES AS INHIBITORS OF CCR9 ACTIVITY NOVARTIS AG (CH) 2008-08-14 — — WO claimed
EP-2118060-B1 1-BENZENESULFONYL-1H-INDOLE DERIVATIVES AS INHIBITORS OF CCR9 ACTIVITY NOVARTIS AG (CH) 2010-10-06 — — EP disclosed
US-20100075963-A1 Pharmaceutically Active Benzensulphonyl-Indols NOVARTIS AG (CH) 2010-03-25 — — US disclosed
EP-2118060-A1 1-BENZENESULFONYL-1H-INDOLE DERIVATIVES AS INHIBITORS OF CCR9 ACTIVITY Novartis AG (CH) 2009-11-18 — — EP disclosed
WO-2008095908-A1 1-BENZENESULFONYL-1H-INDOLE DERIVATIVES AS INHIBITORS OF CCR9 ACTIVITY NOVARTIS AG (CH) 2008-08-14 — — 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-20100075963-A1 Pharmaceutically Active Benzensulphonyl-Indols CCR9, IDO1, CCR10 AKR1C3 1773/4885AKR1C1 2251/4885LMNA 4391/4885

“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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