SCHEMBL3098780

SCHEMBL3098780

COc1ccc(-c2ccc(S(=O)(=O)O)s2)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 6/20 0.61
MMP2 P08253 5/20 0.56
MMP9 P14780 4/20 0.56
KDM4E B2RXH2 2/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
NPC1 O15118 1/20 0.51
ALDH1A1 P00352 1/20 0.51
GLA P06280 1/20 0.51
GAA P10253 1/20 0.51
MAPT P10636 1/20 0.51
HPGD P15428 1/20 0.51
MMP13 P45452 7/20 0.50
MMP3 P08254 3/20 0.50
MMP8 P22894 1/20 0.50
LMNA P02545 1/20 0.49
MMP1 P03956 5/20 0.46
IKBKB O14920 1/20 0.44
CNR1 P21554 1/20 0.43
HSD17B1 P14061 1/20 0.43
HSD17B2 P37059 1/20 0.43

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
SCHEMBL14569109 0.85 APP (0.63) APPMMP2MMP9KDM4ESMN1; SMN2
SCHEMBL5727440 0.84 HDAC6 (0.56) MMP2MMP9IKBKBCNR1HSD17B1
SCHEMBL959465 0.83 APP (0.61) APPMMP2MMP9KDM4ESMN1; SMN2
SCHEMBL7060203 0.83 MMP2 (0.47) APPMMP2MMP9MMP13MMP3
SCHEMBL3255085 0.83 MMP13 (0.49) MMP2MMP9MAPTMMP13MMP3
SCHEMBL3111282 0.80 MMP2 (0.56) APPMMP2MMP9KDM4ESMN1; SMN2
SCHEMBL7057708 0.80 MMP2 (0.41) MMP2MMP9SMN1; SMN2NPC1MMP13
SCHEMBL11519257 0.78 APP (0.54) APPMMP2MMP9ALDH1A1GAA
SCHEMBL1181273 0.78 APP (1.00) APPKDM4ESMN1; SMN2NPC1ALDH1A1
SCHEMBL5727054 0.77 RAB9A (0.46) APPMMP2MMP9KDM4ESMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7122538-B2 Sulfonamide derivatives as antipsychotic agents GLAXO GROUP LIMITED (GB) 2006-10-17 US claimed
EP-1549639-B1 SULPHONAMIDE DERIVATIVES AS ANTIPSYCHOTIC AGENTS GLAXO GROUP LTD (GB) 2006-05-24 EP claimed
US-20060063757-A1 Sulfonamide derivatives as antipsychotic agents GLAXO GROUP LIMITED (GB) 2006-03-23 US claimed
EP-1549639-A1 SULPHONAMIDE DERIVATIVES AS ANTIPSYCHOTIC AGENTS GLAXO GROUP LIMITED (GB) 2005-07-06 EP claimed
WO-2004031181-A1 SULFONAMIDE DERIVATIVES AS ANTIPSYCHOTIC AGENTS GLAXO GROUP LIMITED (GB) 2004-04-15 WO claimed
US-20100279986-A1 HETEROCYCLIC DERIVED METALLOPROTEASE INHIBITORS JANSSEN PHARMACEUTICA N.V. (BE) 2010-11-04 US disclosed
US-7803793-B2 Heterocyclic derived metalloprotease inhibitors JANSSEN PHARMACEUTICA NV (BE) 2010-09-28 US disclosed
EP-2089365-A1 HETEROCYCLIC DERIVED METALLOPROTEASE INHIBITORS Janssen Pharmaceutica, N.V. (BE) 2009-08-19 EP disclosed
US-20080103129-A1 HETEROCYCLIC DERIVED METALLOPROTEASE INHIBITORS JANSSEN PHARMACEUTICA N.V. (BE) 2008-05-01 US disclosed
WO-2008045668-A1 HETEROCYCLIC DERIVED METALLOPROTEASE INHIBITORS JANSSEN PHARMACEUTICA N.V. (BE) 2008-04-17 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 (3 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-20080103129-A1 HETEROCYCLIC DERIVED METALLOPROTEASE INHIBITORS ADAM17, MMP25, ADAM33 APP 290/4885MMP2 16/4885MMP9 8/4885
US-20060063757-A1 Sulfonamide derivatives as antipsychotic agents SIGMAR1, CHRM1, NPSR1 APP 3590/4885MMP2 4785/4885MMP9 4681/4885
US-20100279986-A1 HETEROCYCLIC DERIVED METALLOPROTEASE INHIBITORS ADAM17, MMP25, ADAM33 APP 290/4885MMP2 16/4885MMP9 8/4885

“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.