SCHEMBL4898221

SCHEMBL4898221

CCc1ccc(S(=O)(=O)NCCSc2ccc(C(F)(F)F)cn2)cc1C(=O)OC

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 11/20 0.46
PKM P14618 2/20 0.46
L3MBTL1 Q9Y468 2/20 0.44
GAA P10253 1/20 0.40
LMNA P02545 5/20 0.40
HTT P42858 4/20 0.39
TSHR P16473 3/20 0.39
USP2 O75604 1/20 0.39
IDH2 P48735 2/20 0.38
KDM4E B2RXH2 1/20 0.38
KMT2A Q03164 2/20 0.38
MAPT P10636 1/20 0.38
HPGD P15428 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
MEN1 O00255 1/20 0.37
HSD17B10 Q99714 1/20 0.36
CFTR P13569 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
SCHEMBL4900537 0.91 ALDH1A1 (0.50) ALDH1A1PKML3MBTL1GAALMNA
SCHEMBL4905465 0.91 ALDH1A1 (0.48) ALDH1A1PKML3MBTL1LMNAHTT
SCHEMBL4906080 0.86 ALDH1A1 (0.47) ALDH1A1L3MBTL1GAALMNAHTT
SCHEMBL4895719 0.85 ALDH1A1 (0.48) ALDH1A1PKML3MBTL1GAALMNA
SCHEMBL4906535 0.82 ALDH1A1 (0.51) ALDH1A1PKML3MBTL1LMNAHTT
SCHEMBL4904076 0.79 ALDH1A1 (0.39) ALDH1A1PKML3MBTL1LMNAHTT
SCHEMBL4898233 0.79 ALDH1A1 (0.41) ALDH1A1PKML3MBTL1GAALMNA
SCHEMBL4903898 0.78 ALDH1A1 (0.47) ALDH1A1L3MBTL1GAALMNAHTT
SCHEMBL4895673 0.77 ALDH1A1 (0.46) ALDH1A1GAALMNAKMT2AMAPT
SCHEMBL4900064 0.76 ALDH1A1 (0.52) ALDH1A1GAALMNAHTTTSHR

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-20080090829-A1 SUBSTITUTED HETEROARYL- AND PHENYLSULFAMOYL COMPOUNDS PFIZER INC. 2008-04-17 US disclosed
US-20080090829-A1 SUBSTITUTED HETEROARYL- AND PHENYLSULFAMOYL COMPOUNDS PFIZER INC. 2008-04-17 US disclosed
US-20080090829-A1 SUBSTITUTED HETEROARYL- AND PHENYLSULFAMOYL COMPOUNDS PFIZER INC. 2008-04-17 US disclosed
US-20060229363-A1 Substituted Heteroaryl- and Phenylsulfamoyl Compounds HAMANAKA ERNEST S 2006-10-12 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 (2 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-20060229363-A1 Substituted Heteroaryl- and Phenylsulfamoyl Compounds PPARA, PPARG, PPARD ALDH1A1 2664/4885PKM 896/4885L3MBTL1 1234/4885
US-20080090829-A1 SUBSTITUTED HETEROARYL- AND PHENYLSULFAMOYL COMPOUNDS PPARA, PPARG, PPARD ALDH1A1 2956/4885PKM 861/4885L3MBTL1 1246/4885

“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.