SCHEMBL4096084

SCHEMBL4096084

COc1cc(C)c(S(=O)(=O)N(CCOCC(=O)N2CCn3cccc3C2c2cccnc2)Cc2ccccc2)c(C)c1C

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.44
ALDH1A1 P00352 9/20 0.44
KMT2A Q03164 4/20 0.43
MEN1 O00255 2/20 0.43
RECQL P46063 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
TDP1 Q9NUW8 1/20 0.39
TP53 P04637 1/20 0.39
HTT P42858 1/20 0.39
KDM4E B2RXH2 1/20 0.38
AVPR1A P37288 3/20 0.37
PDE4A P27815 1/20 0.36
PDE4B Q07343 1/20 0.36
PDE4C Q08493 1/20 0.36
PDE4D Q08499 1/20 0.36
GAA P10253 2/20 0.36
MAPK1 P28482 1/20 0.36
NPSR1 Q6W5P4 1/20 0.35
L3MBTL1 Q9Y468 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
SCHEMBL4095023 0.91 AVPR1A (0.37) MAPTALDH1A1KMT2AMEN1RECQL
SCHEMBL4094722 0.90 MAPT (0.43) MAPTALDH1A1KMT2AMEN1RECQL
SCHEMBL4090831 0.89 MAPT (0.46) MAPTALDH1A1TDP1TP53HTT
SCHEMBL4090935 0.87 AVPR1A (0.40) ALDH1A1HTTAVPR1A
SCHEMBL4081206 0.85 ALDH1A1 (0.37) MAPTALDH1A1KDM4EAVPR1AL3MBTL1
SCHEMBL4085935 0.85 AVPR1A (0.39) ALDH1A1HTTAVPR1A
SCHEMBL4091706 0.85 BDKRB1 (0.44) ALDH1A1KDM4EL3MBTL1
SCHEMBL4084780 0.85 AVPR1A (0.39) ALDH1A1HTTKDM4EAVPR1A
SCHEMBL4091210 0.84 BDKRB1 (0.43) ALDH1A1
SCHEMBL4086370 0.82 BDKRB1 (0.43) ALDH1A1KDM4EL3MBTL1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8263598-B2 Substituted sulfonamide compounds GRUENENTHAL GMBH (DE) 2012-09-11 US claimed
US-20090186899-A1 Substituted Sulfonamide Compounds GRUENENTHAL GMBH (DE) 2009-07-23 US claimed
US-8263598-B2 Substituted sulfonamide compounds GRUENENTHAL GMBH (DE) 2012-09-11 US disclosed
US-20090186899-A1 Substituted Sulfonamide Compounds GRUENENTHAL GMBH (DE) 2009-07-23 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-20090186899-A1 Substituted Sulfonamide Compounds BDKRB1, BDKRB2, NPSR1 MAPT 3648/4885ALDH1A1 3693/4885KMT2A 1528/4885

“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.