SCHEMBL4174243

SCHEMBL4174243

N#C/C(=C\c1ccc(Br)cc1)S(=O)(=O)Cc1ccc(Cl)cc1

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
EGFR P00533 3/20 0.42
ERBB2 P04626 2/20 0.42
KMT2A Q03164 5/20 0.42
LMNA P02545 3/20 0.42
ALDH1A1 P00352 1/20 0.42
BRAF P15056 2/20 0.41
MAPT P10636 1/20 0.41
HSP90AA1 P07900 1/20 0.41
NLRP3 Q96P20 1/20 0.39
MEN1 O00255 3/20 0.38
GPR183 P32249 1/20 0.38
PKM P14618 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
PPME1 Q9Y570 1/20 0.37
HTT P42858 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
NSD2 O96028 1/20 0.36
IDE P14735 1/20 0.36

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
SCHEMBL4174249 1.00 EGFR (0.42) EGFRERBB2KMT2ALMNAALDH1A1
SCHEMBL4174254 1.00 EGFR (0.42) EGFRERBB2KMT2ALMNAALDH1A1
SCHEMBL4191717 0.93 BRAF (0.45) EGFRKMT2ABRAFHSP90AA1NLRP3
SCHEMBL4191715 0.93 BRAF (0.45) EGFRKMT2ABRAFHSP90AA1NLRP3
SCHEMBL4191711 0.93 BRAF (0.45) EGFRKMT2ABRAFHSP90AA1NLRP3
SCHEMBL4174178 0.86 PKM (0.52) EGFRERBB2KMT2ALMNAALDH1A1
SCHEMBL4191735 0.86 BRAF (0.55) EGFRERBB2KMT2AALDH1A1BRAF
SCHEMBL4174169 0.86 PKM (0.52) EGFRERBB2KMT2ALMNAALDH1A1
SCHEMBL4174174 0.86 PKM (0.52) EGFRERBB2KMT2ALMNAALDH1A1
SCHEMBL4182900 0.86 BRAF (0.55) EGFRERBB2KMT2AALDH1A1BRAF

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-20090191193-A1 Aryl Vinyl Sulfides, Sulfones, Sulfoxides and Sulfonamides, Derivatives Thereof and Therapeutic Uses Thereof TEMPLE UNIVERSITY-OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2009-07-30 US claimed
US-20090191193-A1 Aryl Vinyl Sulfides, Sulfones, Sulfoxides and Sulfonamides, Derivatives Thereof and Therapeutic Uses Thereof TEMPLE UNIVERSITY-OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2009-07-30 US 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-20090191193-A1 Aryl Vinyl Sulfides, Sulfones, Sulfoxides and Sulfonamides, Derivatives Thereof and Therapeutic Uses Thereof ARSA, STS, SULT2A1 EGFR 66/4885ERBB2 23/4885KMT2A 469/4885

“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.