SCHEMBL2117700

SCHEMBL2117700

COc1ccc(-c2ccc(C)c(NS(=O)(=O)c3ccco3)c2)nc1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.46
CCR2 P41597 3/20 0.42
ALDH1A1 P00352 2/20 0.41
CYP2C9 P11712 1/20 0.41
TSHR P16473 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
PTGER4 P35408 5/20 0.41
KEAP1 Q14145 1/20 0.39
TNKS O95271 1/20 0.38
SGK1 O00141 1/20 0.37
BRAF P15056 1/20 0.37
GHSR Q92847 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
SCHEMBL2119847 0.82 CCR2 (0.41) MAPTCCR2SGK1
SCHEMBL2118122 0.82 MAPT (0.48) MAPTALDH1A1CYP2C9TSHRNPSR1
SCHEMBL2119523 0.81 MAPT (0.50) MAPTALDH1A1CYP2C9TSHRNPSR1
SCHEMBL2121455 0.81 MAPT (0.42) MAPTALDH1A1CYP2C9TSHRNPSR1
SCHEMBL2118300 0.79 MAPT (0.48) MAPTALDH1A1CYP2C9TSHRNPSR1
SCHEMBL2120135 0.79 KMT2A (0.56) MAPTALDH1A1
SCHEMBL2116839 0.79 MAPT (0.48) MAPTALDH1A1CYP2C9TSHRNPSR1
SCHEMBL2118706 0.79 TRIM24 (0.45) MAPTALDH1A1CYP2C9TSHRNPSR1
SCHEMBL2119462 0.79 LMNA (0.55) MAPTALDH1A1CYP2C9TSHRNPSR1
SCHEMBL2120161 0.79 MAPT (0.54) MAPTALDH1A1CYP2C9TSHRNPSR1

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 4747/4885CCR2 894/4885ALDH1A1 1063/4885

“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.