SCHEMBL95330

SCHEMBL95330

[CH2]c1ccc(NS(=O)(=O)CC(F)(F)F)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PGR P06401 1/20 0.48
KIF11 P52732 3/20 0.44
CYP17A1 P05093 1/20 0.40
HPGD P15428 2/20 0.39
LMNA P02545 1/20 0.39
HTT P42858 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
CA2 P00918 2/20 0.38
CA1 P00915 1/20 0.38
KMT2A Q03164 1/20 0.38
DPP4 P27487 1/20 0.37
DPP7 Q9UHL4 1/20 0.37
PPARG P37231 1/20 0.37
PPARA Q07869 1/20 0.37
PTPN1 P18031 1/20 0.37
NR3C2 P08235 1/20 0.37
PTPN11 Q06124 1/20 0.36
HSD17B1 P14061 1/20 0.36
HSD17B2 P37059 1/20 0.36
MMP12 P39900 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
SCHEMBL10192135 0.81 PGR (0.51) PGRKIF11CYP17A1HPGDLMNA
SCHEMBL14466586 0.81 PGR (0.48) PGRKIF11CYP17A1HPGDLMNA
SCHEMBL10622850 0.81 KMT2A (0.47) PGRKIF11HPGDLMNACA2
SCHEMBL13797611 0.79 PGR (0.49) PGRKIF11CYP17A1HPGDLMNA
SCHEMBL6798952 0.79 PGR (0.46) PGRKIF11CYP17A1HPGDLMNA
SCHEMBL4129798 0.78 PGR (0.48) PGRKIF11CYP17A1HPGDLMNA
SCHEMBL7988528 0.76 HPGD (0.64) PGRKIF11HPGDLMNAHTT
SCHEMBL13034867 0.76 ALDH1A1 (0.50) PGRKIF11HPGDLMNAHTT
SCHEMBL12678580 0.75 PGR (0.46) PGRKIF11CYP17A1HPGDLMNA
SCHEMBL7435640 0.75 PTPN1 (0.63) KIF11SMN1; SMN2CA2CA1PPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8362252-B2 Carbostyril compound OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2013-01-29 US disclosed
EP-1797082-B1 CARBOSTYRIL COMPOUND OTSUKA PHARMA CO LTD (JP) 2012-08-29 EP disclosed
EP-2426128-A1 Carbostyril compound Otsuka Pharmaceutical Co., Limited (JP) 2012-03-07 EP disclosed
US-20100261705-A1 CARBOSTYRIL COMPOUND OTSUKA PHARMACEUTICAL CO., LTD. 2010-10-14 US disclosed
US-7777038-B2 Carbostyril compound OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2010-08-17 US disclosed
US-20090326008-A1 NF-kappa B Inhibitor OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2009-12-31 US disclosed
EP-2043644-A1 NF- B INHIBITOR Otsuka Pharmaceutical Co., Ltd. (JP) 2009-04-08 EP disclosed
WO-2008010601-A1 NF- ϰB INHIBITOR OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2008-01-24 WO disclosed
US-20070179173-A1 Carbostyril compound OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2007-08-02 US disclosed
EP-1797082-A1 CARBOSTYRIL COMPOUND Otsuka Pharmaceutical Company, Limited (JP) 2007-06-20 EP disclosed
WO-2006035954-A1 CARBOSTYRIL COMPOUND OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2006-04-06 WO 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 (3 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-20090326008-A1 NF-kappa B Inhibitor NFKBIA, NFKB2, IKBKB PGR 2725/4885KIF11 3962/4885CYP17A1 1372/4885
US-20070179173-A1 Carbostyril compound GTF2F1, F3, GTF2F2 PGR 3206/4885KIF11 2800/4885CYP17A1 2074/4885
US-20100261705-A1 CARBOSTYRIL COMPOUND GTF2F1, F3, GTF2F2 PGR 3206/4885KIF11 2800/4885CYP17A1 2074/4885

“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.