SCHEMBL4178927

SCHEMBL4178927

N#C/C(=C\c1ccc(Br)cc1)S(=O)(=O)Nc1ccc(Br)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.49
MAPT P10636 1/20 0.49
KMT2A Q03164 3/20 0.46
LMNA P02545 2/20 0.46
ALDH1A1 P00352 2/20 0.46
TGM2 P21980 1/20 0.44
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
EGFR P00533 2/20 0.42
PKM P14618 3/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
NLRP3 Q96P20 3/20 0.39
HPGD P15428 2/20 0.38
HDAC1 Q13547 1/20 0.38
IDO1 P14902 1/20 0.37
GAA P10253 2/20 0.37
MEN1 O00255 1/20 0.37
POLB P06746 1/20 0.37
ALPG P10696 1/20 0.37
ALOX15 P16050 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
SCHEMBL4178935 1.00 KDM4E (0.49) KDM4EMAPTKMT2ALMNAALDH1A1
SCHEMBL4178931 1.00 KDM4E (0.49) KDM4EMAPTKMT2ALMNAALDH1A1
SCHEMBL4191693 0.93 PKM (0.52) KDM4EMAPTKMT2ALMNAALDH1A1
SCHEMBL4191692 0.93 PKM (0.52) KDM4EMAPTKMT2ALMNAALDH1A1
SCHEMBL4179676 0.93 MAPT (0.44) KDM4EMAPTKMT2ALMNAALDH1A1
SCHEMBL4179674 0.93 MAPT (0.44) KDM4EMAPTKMT2ALMNAALDH1A1
SCHEMBL4191689 0.93 PKM (0.52) KDM4EMAPTKMT2ALMNAALDH1A1
SCHEMBL4179677 0.93 MAPT (0.44) KDM4EMAPTKMT2ALMNAALDH1A1
SCHEMBL4179357 0.89 HPGD (0.54) KDM4EMAPTKMT2AALDH1A1CA1
SCHEMBL4184760 0.89 MAPT (0.48) KDM4EMAPTKMT2ALMNAALDH1A1

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 KDM4E 1688/4885MAPT 3633/4885KMT2A 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.