SCHEMBL8526440

SCHEMBL8526440

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

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 3/20 0.52
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CA5A P35218 1/20 0.46
CA9 Q16790 1/20 0.46
SCN4A P35499 2/20 0.45
DPP4 P27487 2/20 0.44
F2 P00734 1/20 0.44
PTGES2 Q9H7Z7 1/20 0.42

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
SCHEMBL17287844 0.86 GBA1 (0.52) GBA1SCN4ADPP4F2
SCHEMBL2486785 0.83 GBA1 (0.49) GBA1SCN4ADPP4F2
SCHEMBL9298053 0.83 GBA1 (0.49) GBA1SCN4ADPP4F2
SCHEMBL4204978 0.81 CA1 (0.50) GBA1CA1CA2CA5ACA9
SCHEMBL28956494 0.81 GBA1 (0.56) GBA1CA1CA2CA5ACA9
SCHEMBL12497701 0.81 GBA1 (0.47) GBA1CA1CA2CA5ACA9
SCHEMBL390880 0.78 GABBR2 (0.49) CA1CA2CA5ACA9SCN4A
SCHEMBL6432062 0.77 DPP4 (0.50) GBA1CA1CA2CA5ACA9
Hydrochloric Acid SCHEMBL29143639 0.77 GBA1 (0.47) GBA1SCN4APTGES2
SCHEMBL17258982 0.76 PTGES2 (0.57) GBA1CA1CA2CA5ACA9

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
EP-3186232-A1 P38 MAP KINASE INHIBITING INDANYL UREA COMPOUNDS Torrent Pharmaceuticals Limited (IN) 2017-07-05 EP claimed
WO-2016030852-A1 P38 MAP KINASE INHIBITING INDANYL UREA COMPOUNDS TORRENT PHARMACEUTICALS LIMITED (IN) 2016-03-03 WO claimed
EP-2683704-B1 BRANCHED OXATHIAZINE DERIVATIVES, METHOD FOR THE PRODUCTION THEREOF, USE THEREOF AS MEDICINE AND DRUG CONTAINING SAID DERIVATIVES AND USE THEREOF SANOFI SA (FR) 2014-12-17 EP disclosed
EP-2683704-B1 BRANCHED OXATHIAZINE DERIVATIVES, METHOD FOR THE PRODUCTION THEREOF, USE THEREOF AS MEDICINE AND DRUG CONTAINING SAID DERIVATIVES AND USE THEREOF SANOFI SA (FR) 2014-12-17 EP disclosed
US-8828995-B2 Branched oxathiazine derivatives, method for the production thereof, use thereof as medicine and drug containing said derivatives and use thereof SANOFI (FR) 2014-09-09 US disclosed
US-8828995-B2 Branched oxathiazine derivatives, method for the production thereof, use thereof as medicine and drug containing said derivatives and use thereof SANOFI (FR) 2014-09-09 US disclosed
EP-2683704-A1 BRANCHED OXATHIAZINE DERIVATIVES, METHOD FOR THE PRODUCTION THEREOF, USE THEREOF AS MEDICINE AND DRUG CONTAINING SAID DERIVATIVES AND USE THEREOF SANOFI (FR) 2014-01-15 EP disclosed
WO-2012120053-A1 BRANCHED OXATHIAZINE DERIVATIVES, METHOD FOR THE PRODUCTION THEREOF, USE THEREOF AS MEDICINE AND DRUG CONTAINING SAID DERIVATIVES AND USE THEREOF SANOFI (FR) 2012-09-13 WO disclosed
WO-2012120053-A1 BRANCHED OXATHIAZINE DERIVATIVES, METHOD FOR THE PRODUCTION THEREOF, USE THEREOF AS MEDICINE AND DRUG CONTAINING SAID DERIVATIVES AND USE THEREOF SANOFI (FR) 2012-09-13 WO disclosed
EP-0885186-A1 AMINO ACID DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THESE COMPOUNDS AND PROCESSES FOR PREPARING THEM Dr. Karl Thomae GmbH (DE) 1998-12-23 EP disclosed
WO-1997019911-A1 AMINO ACID DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THESE COMPOUNDS AND PROCESSES FOR PREPARING THEM DR. KARL THOMAE GMBH (DE) 1997-06-05 WO disclosed