SCHEMBL4185236

SCHEMBL4185236

COc1ccc(CS(=O)(=O)C(C#N)=Cc2ccc(F)cc2Cl)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.45
MEN1 O00255 3/20 0.45
EGFR P00533 2/20 0.41
ERBB2 P04626 2/20 0.41
POLB P06746 3/20 0.40
HPGD P15428 2/20 0.38
PKM P14618 1/20 0.38
LMNA P02545 2/20 0.38
MAPT P10636 4/20 0.37
ALDH1A1 P00352 3/20 0.37
TP53 P04637 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA4 P22748 1/20 0.37
CA7 P43166 1/20 0.37
NPSR1 Q6W5P4 2/20 0.37
NPC1 O15118 1/20 0.37
S1PR2 O95136 1/20 0.37
S1PR4 O95977 1/20 0.37
S1PR1 P21453 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
SCHEMBL4185235 1.00 KMT2A (0.45) KMT2AMEN1EGFRERBB2POLB
SCHEMBL4185233 1.00 KMT2A (0.45) KMT2AMEN1EGFRERBB2POLB
SCHEMBL4191982 0.89 LMNA (0.48) KMT2AMEN1EGFRERBB2POLB
SCHEMBL4191974 0.89 LMNA (0.48) KMT2AMEN1EGFRERBB2POLB
SCHEMBL4191978 0.89 LMNA (0.48) KMT2AMEN1EGFRERBB2POLB
SCHEMBL4178196 0.88 GABRA1 (0.41) KMT2AEGFRERBB2POLBPKM
SCHEMBL4178190 0.88 GABRA1 (0.41) KMT2AEGFRERBB2POLBPKM
SCHEMBL4178193 0.88 GABRA1 (0.41) KMT2AEGFRERBB2POLBPKM
SCHEMBL4182699 0.83 HPGD (0.40) KMT2AMEN1EGFRERBB2POLB
SCHEMBL4182694 0.83 HPGD (0.40) KMT2AMEN1EGFRERBB2POLB

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 4 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
EP-2046322-A2 ARYL VINYL SULFIDES, SULFONES, SULFOXIDES AND SULFONAMIDES, DERIVATIVES THEREOF AND THERAPEUTIC USES THEREOF Temple University of the Commonwealth System of Higher Education (US) 2009-04-15 EP disclosed
WO-2008016682-A2 ARYL VINYL SULFIDES, SULFONES, SULFOXIDES AND SULFONAMIDES, DERIVATIVES THEREOF AND THERAPEUTIC USES THEREOF TEMPLE UNIVERSITY - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2008-02-07 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 (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 KMT2A 469/4885MEN1 2503/4885EGFR 66/4885

“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.