SCHEMBL2116556

SCHEMBL2116556

COc1nccc(S(=O)(=O)Nc2cc(C)cc(-c3ccc(C#N)c(C#N)n3)c2)n1

nearest known ligand 0.38

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SGK1 O00141 8/20 0.38
SCN9A Q15858 9/20 0.36
SCN5A Q14524 2/20 0.36
SYK P43405 2/20 0.35
ALPL P05186 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
SCHEMBL2118304 0.84 SGK1 (0.36) SGK1SCN9ASCN5AALPL
SCHEMBL2118117 0.79 SLC22A12 (0.36) SGK1SCN9ASYKALPL
SCHEMBL2117206 0.77 SYK (0.46) SGK1SYK
SCHEMBL2119855 0.75 MEN1 (0.43) SGK1
SCHEMBL2117811 0.75 HPGD (0.50)
SCHEMBL2117885 0.75 ALDH1A1 (0.37) SGK1SCN9A
SCHEMBL2120158 0.75 TP53 (0.40) SGK1SCN9A
SCHEMBL2119820 0.74 MAPT (0.38) SGK1
SCHEMBL2119291 0.72 KMT2A (0.35) SGK1
SCHEMBL2119384 0.72 MAPT (0.36) SGK1SCN9A

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 1 patent. 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

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 SGK1 4188/4885SCN9A 3268/4885SCN5A 1248/4885

“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.