SCHEMBL2332987

SCHEMBL2332987

COc1cc(CN(CCCSC)S(=O)(=O)c2ccc(Cl)cc2)ccc1OCCc1scnc1C

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
ALDH1A1 P00352 7/20 0.40
TAS2R14 Q9NYV8 2/20 0.39
LMNA P02545 4/20 0.38
SMN1; SMN2 Q16637 4/20 0.38
TSHR P16473 2/20 0.38
MAPT P10636 1/20 0.38
HTT P42858 2/20 0.38
PTGER1 P34995 1/20 0.37
THRB P10828 1/20 0.37
HPGD P15428 1/20 0.37
HIF1A Q16665 1/20 0.37
EPAS1 Q99814 1/20 0.37

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
SCHEMBL2338966 0.91 MEN1 (0.42) MEN1KMT2AALDH1A1TAS2R14LMNA
SCHEMBL2339348 0.88 ALDH1A1 (0.43) MEN1KMT2AALDH1A1TAS2R14LMNA
SCHEMBL2339713 0.88 MEN1 (0.41) MEN1KMT2AALDH1A1TAS2R14LMNA
SCHEMBL2333362 0.87 HIF1A (0.46) MEN1KMT2AALDH1A1TAS2R14LMNA
SCHEMBL2338098 0.86 ALDH1A1 (0.40) MEN1KMT2AALDH1A1TAS2R14LMNA
SCHEMBL2337909 0.86 ALDH1A1 (0.44) MEN1KMT2AALDH1A1TAS2R14LMNA
SCHEMBL5668449 0.85 MEN1 (0.40) MEN1KMT2AALDH1A1TAS2R14LMNA
SCHEMBL2332019 0.85 HIF1A (0.45) MEN1KMT2AALDH1A1TAS2R14LMNA
SCHEMBL2332022 0.84 ALDH1A1 (0.39) MEN1KMT2AALDH1A1TAS2R14LMNA
SCHEMBL2335244 0.84 TP53 (0.44) ALDH1A1TAS2R14LMNASMN1; SMN2HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120270902-A1 N-substituted benzene sulfonamides ELAN PHARMACEUTICALS, INC. (US) 2012-10-25 US claimed
EP-1723102-A2 N-SUBSTITUTED BENZENE SULFONAMIDES Elan Pharmaceuticals, Inc. (US) 2006-11-22 EP claimed
US-20050245573-A1 N-substituted benzene sulfonamides ELAN PHARMACEUTICALS, INC. 2005-11-03 US claimed
WO-2005090296-A2 N-SUBSTITUTED BENZENE SULFONAMIDES ELAN PHARMACEUTICALS, INC. (US) 2005-09-29 WO claimed
US-20120270902-A1 N-substituted benzene sulfonamides ELAN PHARMACEUTICALS, INC. (US) 2012-10-25 US disclosed
US-8193389-B2 N-substituted benzene sulfonamides ELAN PHARMACEUTICALS, INC. (US) 2012-06-05 US disclosed
EP-2374792-A1 N-substituted benzene sulfonamides Elan Pharmaceuticals Inc. (US) 2011-10-12 EP disclosed
EP-2360142-A1 N-substituted benzene sulfonamides Elan Pharmaceuticals Inc. (US) 2011-08-24 EP disclosed
EP-1723102-A2 N-SUBSTITUTED BENZENE SULFONAMIDES Elan Pharmaceuticals, Inc. (US) 2006-11-22 EP disclosed
US-20050245573-A1 N-substituted benzene sulfonamides ELAN PHARMACEUTICALS, INC. 2005-11-03 US disclosed
WO-2005090296-A2 N-SUBSTITUTED BENZENE SULFONAMIDES ELAN PHARMACEUTICALS, INC. (US) 2005-09-29 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-20050245573-A1 N-substituted benzene sulfonamides PSEN1, PSEN2, BCHE MEN1 2523/4885KMT2A 1360/4885ALDH1A1 665/4885
US-20120270902-A1 N-substituted benzene sulfonamides PSEN1, PSEN2, BCHE MEN1 2523/4885KMT2A 1360/4885ALDH1A1 665/4885

“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.