SCHEMBL6095340

SCHEMBL6095340

CS(=O)(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.54
HTT P42858 1/20 0.54
RECQL P46063 1/20 0.54
MAPT P10636 2/20 0.53
CYP2D6 P10635 1/20 0.51
HRH3 Q9Y5N1 1/20 0.51
RORC P51449 9/20 0.48
LMNA P02545 3/20 0.47
ALDH1A1 P00352 3/20 0.46
RORA P35398 1/20 0.46
KMT2A Q03164 1/20 0.46

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
SCHEMBL3274096 0.82 HRH3 (0.55) SMN1; SMN2HTTRECQLMAPTHRH3
SCHEMBL6098631 0.81 SMN1; SMN2 (0.47) SMN1; SMN2HTTRECQLMAPTLMNA
SCHEMBL15829990 0.81 FPR2 (0.59) SMN1; SMN2MAPTCYP2D6HRH3RORC
SCHEMBL16038107 0.81 HRH3 (0.56) SMN1; SMN2MAPTCYP2D6HRH3RORC
SCHEMBL27935616 0.80 SIGMAR1 (0.67) SMN1; SMN2HTTRECQLMAPTLMNA
SCHEMBL11044966 0.80 EPHX2 (0.54) SMN1; SMN2MAPTLMNAALDH1A1KMT2A
SCHEMBL6792850 0.80 SMN1; SMN2 (0.46) SMN1; SMN2HTTRECQLMAPTLMNA
SCHEMBL5864825 0.80 ALDH1A1 (0.51) SMN1; SMN2RECQLMAPTCYP2D6LMNA
SCHEMBL18183745 0.80 HRH3 (0.55) SMN1; SMN2MAPTCYP2D6HRH3RORC
SCHEMBL16532717 0.80 SIGMAR1 (0.45) SMN1; SMN2HTTRECQLMAPTCYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2970116-A1 ARYL SULFAMIDE AND SULFAMATE DERIVATIVES AS RORc MODULATORS F. Hoffmann-La Roche AG (CH) 2016-01-20 EP disclosed
CN-105121404-A Aryl sulfonamide and sulfamic acid derivatives as RORc modulators HOFFMANN LA ROCHE 2015-12-02 CN disclosed
US-8912219-B2 Aryl sulfamide and sulfamate derivatives as RORc modulators GENENTECH, INC. (US) 2014-12-16 US disclosed
US-8912219-B2 Aryl sulfamide and sulfamate derivatives as RORc modulators GENENTECH, INC. (US) 2014-12-16 US disclosed
US-8912219-B2 Aryl sulfamide and sulfamate derivatives as RORc modulators GENENTECH, INC. (US) 2014-12-16 US disclosed
WO-2014140059-A1 ARYL SULFAMIDE AND SULFAMATE DERIVATIVES AS RORc MODULATORS F. HOFFMANN-LA ROCHE AG (CH) 2014-09-18 WO disclosed
US-20140275032-A1 ARYL SULFAMIDE AND SULFAMATE DERIVATIVES AS RORc MODULATORS GENENTECH, INC. (US) 2014-09-18 US disclosed
US-20140275032-A1 ARYL SULFAMIDE AND SULFAMATE DERIVATIVES AS RORc MODULATORS GENENTECH, INC. (US) 2014-09-18 US disclosed
US-20140275032-A1 ARYL SULFAMIDE AND SULFAMATE DERIVATIVES AS RORc MODULATORS GENENTECH, INC. (US) 2014-09-18 US disclosed
US-7067670-B2 Sulfamato hydroxamic acid metalloprotease inhibitor WARNER LAMBERT COMPANY (US) 2006-06-27 US disclosed
CN-1216056-C Sulfamidohydroxamic acid metalloprotease inhibitor SEARLE & CO (US) 2005-08-24 CN disclosed
US-20050049280-A1 Sulfamato hydroxamic acid metalloprotease inhibitor PHARMACIA CORPORATION 2005-03-03 US disclosed
US-6800646-B1 Sulfamato hydroxamic acid metalloprotease inhibitor PHARMACIA CORPORATION 2004-10-05 US disclosed
US-6492367-B1 Sulfamato hydroxamic acid metalloprotease inhibitor G. D. SEARLE & COMPANY 2002-12-10 US disclosed
US-6448250-B1 INHIBITS THE ACTIVITY OF ONE OR MORE OF THE FOLLOWING MATRIX METALLOPROTEINASES: MMP-2, MMP-9, AND MMP-13, WHILE EXHIBITING SUBSTANTIALLY LESS INHIBITORY ACTIVITY AGAINST MMP-1 G. D. SEARLE & COMPANY 2002-09-10 US disclosed
CN-1362954-A Sulfamidohydroxamic acid metalloprotease inhibitor SEARLE & CO (US) 2002-08-07 CN disclosed
EP-1157021-A1 SULFAMATO HYDROXAMIC ACID METALLOPROTEASE INHIBITOR G.D. SEARLE & CO. (US) 2001-11-28 EP disclosed
WO-2000046221-A1 SULFAMATO HYDROXAMIC ACID METALLOPROTEASE INHIBITOR G.D. SEARLE & CO. (US) 2000-08-10 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 (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-20050049280-A1 Sulfamato hydroxamic acid metalloprotease inhibitor MMP14, MMP12, MMP17 SMN1; SMN2 1211/4885HTT 1335/4885RECQL 4295/4885
US-20140275032-A1 ARYL SULFAMIDE AND SULFAMATE DERIVATIVES AS RORc MODULATORS RORA, RORC, RORB SMN1; SMN2 2976/4885HTT 3771/4885RECQL 1199/4885

“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.