SCHEMBL2117734

SCHEMBL2117734

COc1ccc(S(=O)(=O)Nc2cc(-c3ccns3)ccc2C)cn1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIT P10721 1/20 0.44
PTGES2 Q9H7Z7 1/20 0.42
ALDH1A1 P00352 4/20 0.40
HPGD P15428 3/20 0.40
LMNA P02545 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
PIK3CG P48736 2/20 0.40
PIK3CD O00329 1/20 0.40
PIK3CA P42336 1/20 0.40
PIK3CB P42338 1/20 0.40
MAPT P10636 4/20 0.39
KDM4E B2RXH2 2/20 0.39
MEN1 O00255 1/20 0.39
PABPC1 P11940 1/20 0.39
KMT2A Q03164 1/20 0.39
CYP2C9 P11712 2/20 0.39
TSHR P16473 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
HSP90AA1 P07900 1/20 0.39
EIF2AK3 Q9NZJ5 1/20 0.38

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
SCHEMBL2116757 0.86 MAPT (0.41) PTGES2ALDH1A1HPGDLMNASMN1; SMN2
SCHEMBL2116804 0.85 KIT (0.46) KITPTGES2ALDH1A1HPGDLMNA
SCHEMBL2118481 0.83 GHSR (0.49) KITPTGES2ALDH1A1HPGDLMNA
SCHEMBL2119816 0.80 KIT (0.45) KITPTGES2ALDH1A1HPGDLMNA
SCHEMBL2117520 0.79 MAPT (0.39) ALDH1A1HPGDSMN1; SMN2PIK3CAMAPT
SCHEMBL2121929 0.78 MAPT (0.51) KITPTGES2ALDH1A1MAPTMEN1
SCHEMBL2119780 0.78 KIT (0.45) KITPTGES2ALDH1A1HPGDLMNA
SCHEMBL2117745 0.78 ALDH1A1 (0.39) ALDH1A1HPGDLMNASMN1; SMN2PIK3CG
SCHEMBL2118182 0.77 TRIM24 (0.54) KITPTGES2ALDH1A1HPGDLMNA
SCHEMBL2117738 0.75 ACLY (0.46) KITPTGES2PIK3CAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120095012-A1 TOLUIDINE SULFONAMIDES AND THEIR USE ELARA PHARMACEUTICALS GMBH (DE) 2012-04-19 US disclosed
EP-2382190-A1 TOLUIDINE SULFONAMIDES AND THEIR USE AS-INHIBITORS European Molecular Biology Laboratory (EMBL) (DE) 2011-11-02 EP 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-20120095012-A1 TOLUIDINE SULFONAMIDES AND THEIR USE HIF1A, HIF1AN, EGLN3 KIT 9/4885PTGES2 566/4885ALDH1A1 1063/4885

“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.