SCHEMBL2118300

SCHEMBL2118300

COc1ccc(-c2ccc(C)c(NS(=O)(=O)c3cccc(C)n3)c2)nc1

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.48
SLC40A1 Q9NP59 2/20 0.45
TNKS O95271 1/20 0.40
PTGER4 P35408 2/20 0.39
ALDH1A1 P00352 1/20 0.39
CYP2C9 P11712 1/20 0.39
TSHR P16473 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
KEAP1 Q14145 1/20 0.39
GHSR Q92847 2/20 0.39
GLO1 Q04760 2/20 0.38
RELA Q04206 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
SCHEMBL2118122 0.87 MAPT (0.48) MAPTTNKSPTGER4ALDH1A1CYP2C9
SCHEMBL2119232 0.84 MAPT (0.45) MAPTTNKSPTGER4ALDH1A1CYP2C9
SCHEMBL2120060 0.82 HSD11B1 (0.45) MAPTSLC40A1GLO1
SCHEMBL2118441 0.81 MAPT (0.43) MAPTTNKSPTGER4ALDH1A1CYP2C9
SCHEMBL2120135 0.79 KMT2A (0.56) MAPTALDH1A1
SCHEMBL2117700 0.79 MAPT (0.46) MAPTTNKSPTGER4ALDH1A1CYP2C9
SCHEMBL2117210 0.79 MAPT (0.42) MAPTPTGER4ALDH1A1CYP2C9TSHR
SCHEMBL2119462 0.79 LMNA (0.55) MAPTALDH1A1CYP2C9TSHRNPSR1
SCHEMBL2120161 0.79 MAPT (0.54) MAPTALDH1A1CYP2C9TSHRNPSR1
SCHEMBL2117841 0.79 MAPT (0.54) MAPTPTGER4ALDH1A1CYP2C9TSHR

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 MAPT 4747/4885SLC40A1 1365/4885TNKS 902/4885

“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.