SCHEMBL96179

SCHEMBL96179

[CH2]c1ccc(NS(=O)(=O)c2c(C)cccc2Cl)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.55
SLC40A1 Q9NP59 1/20 0.50
GAA P10253 3/20 0.49
ALDH1A1 P00352 4/20 0.48
LMNA P02545 2/20 0.48
PGR P06401 3/20 0.42
IDH1 O75874 2/20 0.42
POLB P06746 1/20 0.41
TSHR P16473 1/20 0.41
GFER P55789 1/20 0.41
MAPK1 P28482 1/20 0.41
HTT P42858 1/20 0.41
PKM P14618 2/20 0.41
MAPT P10636 2/20 0.41
IDH2 P48735 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
SLC22A12 Q96S37 2/20 0.39
NR3C1 P04150 1/20 0.39
RAB9A P51151 1/20 0.38

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
SCHEMBL132296 0.89 ATM (0.62) ATMSLC40A1GAAALDH1A1LMNA
SCHEMBL31576015 0.86 ATM (0.55) ATMSLC40A1GAAALDH1A1LMNA
SCHEMBL29053323 0.79 ATM (0.67) ATMGAAALDH1A1LMNAPGR
SCHEMBL95032 0.79 HSD11B1 (0.59) ATMSLC40A1ALDH1A1PGRPKM
SCHEMBL2372660 0.77 SLC40A1 (0.50) ATMSLC40A1GAAALDH1A1LMNA
SCHEMBL2372666 0.75 SLC40A1 (0.51) ATMSLC40A1GAAALDH1A1LMNA
SCHEMBL17174223 0.75 PKM (0.64) ATMGAAALDH1A1LMNAIDH1
SCHEMBL95664 0.75 PGR (0.65) SLC40A1ALDH1A1LMNAPGRMEN1
SCHEMBL94670 0.74 GAA (0.71) GAAALDH1A1LMNAPOLBTSHR
SCHEMBL96292 0.74 PGR (0.65) ALDH1A1LMNAPGRPKMMAPT

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 12 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
CN-101489555-A Nf-kappa OTSUKA PHARMA CO LTD (JP) 2009-07-22 CN 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 ATM 1126/4885SLC40A1 2377/4885GAA 4574/4885
US-20070179173-A1 Carbostyril compound GTF2F1, F3, GTF2F2 ATM 723/4885SLC40A1 1044/4885GAA 4784/4885
US-20100261705-A1 CARBOSTYRIL COMPOUND GTF2F1, F3, GTF2F2 ATM 723/4885SLC40A1 1044/4885GAA 4784/4885

“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.