SCHEMBL2117003

SCHEMBL2117003

CCc1ccc(S(=O)(=O)Nc2cc(-c3ccc(C#N)cc3)ccc2C)o1

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ACLY P53396 5/20 0.43
HSD11B1 P28845 7/20 0.41
PTGES2 Q9H7Z7 1/20 0.38
SGK1 O00141 1/20 0.38
TP53 P04637 1/20 0.37
GRIA1 P42261 1/20 0.36
GRIA2 P42262 1/20 0.36
GRIA3 P42263 1/20 0.36
GRIA4 P48058 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
SCHEMBL2119974 0.87 KDM4E (0.38) HSD11B1SGK1TP53
SCHEMBL2119935 0.82 PGR (0.39) TP53
SCHEMBL2117661 0.80 MAPT (0.35) TP53
SCHEMBL2120200 0.78 ACLY (0.48) ACLYHSD11B1PTGES2SGK1
SCHEMBL2117500 0.78 EDNRA (0.44) TP53
SCHEMBL2120254 0.74 ACLY (0.51) ACLYHSD11B1PTGES2SGK1TP53
SCHEMBL2122228 0.73 ACLY (0.48) ACLYHSD11B1PTGES2
SCHEMBL2119785 0.73 ACLY (0.59) ACLYHSD11B1PTGES2SGK1
SCHEMBL2121455 0.73 MAPT (0.42) TP53
SCHEMBL2117061 0.73 MEN1 (0.39)

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-20120095012-A1 TOLUIDINE SULFONAMIDES AND THEIR USE ELARA PHARMACEUTICALS GMBH (DE) 2012-04-19 US disclosed
EP-2382190-A1 TOLUIDINE SULFONAMIDES AND THEIR USE AS-INHIBITORS European Molecular Biology Laboratory (EMBL) (DE) 2011-11-02 EP 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 ACLY 1578/4885HSD11B1 3376/4885PTGES2 566/4885

“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.