SCHEMBL2486785

SCHEMBL2486785

NC(CS(=O)(=O)O)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 2/20 0.49
SCN4A P35499 3/20 0.47
SRC P12931 1/20 0.44
ALDH1A1 P00352 1/20 0.42
CYP2C19 P33261 1/20 0.41
DPP4 P27487 2/20 0.41
F2 P00734 1/20 0.41

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
SCHEMBL27721990 1.00 GBA1 (0.49) GBA1SCN4ASRCALDH1A1CYP2C19
SCHEMBL8526440 0.83 GBA1 (0.52) GBA1SCN4ADPP4F2
SCHEMBL17287844 0.83 GBA1 (0.52) GBA1SCN4ADPP4F2
SCHEMBL6422777 0.81 PTGS1 (0.50) SCN4AALDH1A1
SCHEMBL2935549 0.80 SRC (0.48) GBA1SRCALDH1A1CYP2C19
SCHEMBL27700349 0.80 TACR1 (0.43) GBA1SRCALDH1A1CYP2C19DPP4
SCHEMBL6034394 0.80 GABBR2 (0.42) GBA1DPP4F2
SCHEMBL6032624 0.80 GABBR2 (0.64) SCN4ACYP2C19
SCHEMBL6033113 0.80 GABBR2 (0.42) DPP4F2
SCHEMBL6033150 0.80 GABBR2 (0.42) GBA1ALDH1A1F2

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 24 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0467856-B1 Aminoalkanesulfonic acid derivatives and pharmaceutical compositions for use in preventing or treating heart diseases NIPPON ZOKI PHARMACEUTICAL CO (JP) 1997-03-19 EP claimed
EP-0467856-A2 Aminoalkanesulfonic acid derivatives and pharmaceutical compositions for use in preventing or treating heart diseases NIPPON ZOKI PHARMACEUTICAL CO. LTD. (JP) 1992-01-22 EP claimed
CN-101851182-B Salt-free preparation method for substituted taurine UNIV BEIJING CHEMICAL 2013-07-17 CN disclosed
US-20120029197-A1 Method for Preparing Sulfur-Containing Compounds THE ROYAL COLLEGE OF SURGEONS IN IRELAND (IE) 2012-02-02 US disclosed
US-20120029197-A1 Method for Preparing Sulfur-Containing Compounds THE ROYAL COLLEGE OF SURGEONS IN IRELAND (IE) 2012-02-02 US disclosed
EP-2376444-A1 A METHOD FOR PREPARING SULFUR-CONTAINING COMPOUNDS The Royal College of Surgeons in Ireland (IE) 2011-10-19 EP disclosed
CN-101148427-B Method for preparing substituted taurine UNIV BEIJING 2010-10-27 CN disclosed
CN-101851182-A Salt-free preparation method for substituted taurine UNIV BEIJING CHEMICAL 2010-10-06 CN disclosed
WO-2010066450-A1 A METHOD FOR PREPARING SULFUR-CONTAINING COMPOUNDS THE ROYAL COLLEGE OF SURGEONS IN IRELAND (IE) 2010-06-17 WO disclosed
WO-2010066450-A1 A METHOD FOR PREPARING SULFUR-CONTAINING COMPOUNDS THE ROYAL COLLEGE OF SURGEONS IN IRELAND (IE) 2010-06-17 WO disclosed
EP-2196456-A1 A method for preparing sulfur-containing compounds Royal College of Surgeons in Ireland (IE) 2010-06-16 EP disclosed
US-20050038000-A1 Methods and compositions for the treatment of amyloid-and epileptogenesis-associated diseases BELLUS HEALTH (INTERNATIONAL) LIMITED (CH) 2005-02-17 US disclosed
WO-2005000406-A2 TREATMENT OF AMYLOID- AND EPILEPTOGENESIS-ASSOCIATED DISEASES NEUROCHEM (INTERNATIONAL) LIMITED (CH) 2005-01-06 WO disclosed
EP-0467856-B1 Aminoalkanesulfonic acid derivatives and pharmaceutical compositions for use in preventing or treating heart diseases NIPPON ZOKI PHARMACEUTICAL CO (JP) 1997-03-19 EP disclosed
CN-1125440-A Fiber reactive anthraquinone dyes HOECHST CELANESE CORP (US) 1996-06-26 CN disclosed
EP-0467856-A2 Aminoalkanesulfonic acid derivatives and pharmaceutical compositions for use in preventing or treating heart diseases NIPPON ZOKI PHARMACEUTICAL CO. LTD. (JP) 1992-01-22 EP disclosed
US-4617382-A PRINTING; DYEING; SILK, LEATHER, WOOL AND POLYAMIDES CIBA-GEIGY CORPORATION (US) 1986-10-14 US disclosed
US-4219473-A Substituted unsymmetrical azo, azomethine 1:2 chromium complexes CIBA-GEIGY CORPORATION (US) 1980-08-26 US disclosed
US-4053462-A UNSYMMETRICAL PHENYL AZO NAPHTHYL CHROMIUM COMPLEX DYES CIBA-GEIGY CORPORATION (US) 1977-10-11 US disclosed
US-4005065-A GOOD FASTNESS TO LIGHT, PERSPIRATION, FULLING, DECATIZING AND CARBONIZING CIBA-GEIGY CORPORATION (US) 1977-01-25 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-20120029197-A1 Method for Preparing Sulfur-Containing Compounds SULT1E1, SULT1A1, TST GBA1 1854/4885SCN4A 362/4885SRC 937/4885
US-20050038000-A1 Methods and compositions for the treatment of amyloid-and epileptogenesis-associated diseases APP, PSEN1, PSEN2 GBA1 21/4885SCN4A 128/4885SRC 4044/4885

“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.