SCHEMBL95548

SCHEMBL95548

[CH2]c1ccc(NS(=O)(=O)c2cc(F)ccc2C)cc1

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTT P42858 3/20 0.55
SMN1; SMN2 Q16637 2/20 0.55
IDH1 O75874 7/20 0.54
ALDH1A1 P00352 4/20 0.52
GAA P10253 1/20 0.52
TSHR P16473 1/20 0.52
PKM P14618 1/20 0.52
TAS2R14 Q9NYV8 1/20 0.52
HPGD P15428 2/20 0.51
NPSR1 Q6W5P4 1/20 0.51
LMNA P02545 4/20 0.51
MAPT P10636 2/20 0.51
MCL1 Q07820 1/20 0.49
MEP1B Q16820 1/20 0.48

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
SCHEMBL95455 0.84 SGK1 (0.52) HTTSMN1; SMN2HPGDNPSR1MAPT
SCHEMBL97723 0.81 POLB (0.50) HTTSMN1; SMN2ALDH1A1PKMHPGD
SCHEMBL95834 0.79 BRD4 (0.51) HTTSMN1; SMN2HPGDNPSR1LMNA
SCHEMBL95378 0.78 ALDH1A1 (0.56) SMN1; SMN2IDH1ALDH1A1GAATSHR
SCHEMBL95317 0.77 SMN1; SMN2 (0.60) HTTSMN1; SMN2IDH1ALDH1A1GAA
SCHEMBL3564236 0.75 SLC16A3 (0.59) HTTIDH1ALDH1A1LMNAMAPT
SCHEMBL2525525 0.75 LMNA (0.65) HTTSMN1; SMN2IDH1ALDH1A1GAA
SCHEMBL7571566 0.74 SMN1; SMN2 (0.57) SMN1; SMN2IDH1ALDH1A1PKMTAS2R14
SCHEMBL97159 0.74 SGK1 (0.44) HTTSMN1; SMN2IDH1ALDH1A1GAA
SCHEMBL9997334 0.74 ALDH1A1 (0.73) IDH1ALDH1A1GAATSHRHPGD

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 HTT 4495/4885SMN1; SMN2 3998/4885IDH1 1279/4885
US-20070179173-A1 Carbostyril compound GTF2F1, F3, GTF2F2 HTT 4175/4885SMN1; SMN2 3084/4885IDH1 3360/4885
US-20100261705-A1 CARBOSTYRIL COMPOUND GTF2F1, F3, GTF2F2 HTT 4175/4885SMN1; SMN2 3084/4885IDH1 3360/4885

“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.