SCHEMBL4473788

SCHEMBL4473788

CCCCCC=C(C(N)=O)S(=O)(=O)CCCCC

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
EP300 Q09472 1/20 0.42
FAAH O00519 6/20 0.41
SOAT1 P35610 2/20 0.41
MEN1 O00255 1/20 0.41
TP53 P04637 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C19 P33261 1/20 0.41
KMT2A Q03164 1/20 0.41
EPHX2 P34913 2/20 0.39
CNR1 P21554 1/20 0.39
KDM4E B2RXH2 2/20 0.38
CA2 P00918 2/20 0.35
GRIK1 P39086 1/20 0.35
ENPP2 Q13822 1/20 0.35

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
SCHEMBL4473785 1.00 EP300 (0.42) EP300FAAHSOAT1MEN1TP53
SCHEMBL8089344 0.77 GRIK1 (0.38) EP300FAAHSOAT1MEN1TP53
SCHEMBL7529207 0.75 GRIK1 (0.37) EP300FAAHSOAT1MEN1TP53
SCHEMBL3263465 0.74 CES2 (0.48) EP300SOAT1EPHX2
SCHEMBL3263462 0.74 CES2 (0.48) EP300SOAT1EPHX2
SCHEMBL4794021 0.73 CA2 (0.45) FAAHSOAT1MEN1TP53CYP1A2
SCHEMBL5015091 0.71 CA2 (0.48) FAAHSOAT1MEN1TP53CYP1A2
SCHEMBL3217870 0.71 ENPP2 (0.41) FAAHTP53CA2ENPP2
SCHEMBL6557190 0.70 EP300 (0.55) EP300FAAHSOAT1MEN1TP53
SCHEMBL6056971 0.70 EP300 (0.50) EP300FAAHSOAT1MEN1TP53

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 3 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 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 EP300 2849/4885FAAH 3560/4885SOAT1 1840/4885

“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.