SCHEMBL12493897

SCHEMBL12493897

COc1ccc(CNS(=O)(=O)Cc2ccc(Br)cc2)c(OC)c1

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ APLNR P35414 1/20 0.52
▸ TP53 P04637 1/20 0.51
▸ ALDH1A1 P00352 1/20 0.47
▸ MAPK1 P28482 1/20 0.47
▸ PTK2B Q14289 1/20 0.47
▸ HTR2A P28223 1/20 0.46
▸ HTR2C P28335 1/20 0.46
▸ HDAC3 O15379 1/20 0.46
▸ HDAC1 Q13547 1/20 0.46
▸ HDAC2 Q92769 1/20 0.46
▸ HDAC8 Q9BY41 1/20 0.46
▸ MEN1 O00255 4/20 0.45
▸ KMT2A Q03164 4/20 0.45
▸ SMN1; SMN2 Q16637 2/20 0.44
▸ GAA P10253 2/20 0.43
▸ NPC1 O15118 1/20 0.43
▸ MAPT P10636 1/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43

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
SCHEMBL12493456 0.89 MMP8 (0.50) APLNRTP53HTR2AHTR2CHDAC3
SCHEMBL12494088 0.87 APLNR (0.52) APLNRTP53ALDH1A1MAPK1PTK2B
SCHEMBL12494016 0.87 ALDH1A1 (0.62) APLNRTP53ALDH1A1MAPK1PTK2B
SCHEMBL12494013 0.86 SMN1; SMN2 (0.50) APLNRTP53ALDH1A1MAPK1PTK2B
SCHEMBL30714247 0.86 APLNR (0.49) APLNRTP53HTR2AHTR2CHDAC3
SCHEMBL12492802 0.85 ALDH1A1 (0.54) APLNRTP53ALDH1A1MAPK1PTK2B
SCHEMBL12493486 0.84 L3MBTL1 (0.54) APLNRTP53ALDH1A1MAPK1PTK2B
SCHEMBL12700064 0.84 APLNR (0.49) APLNRTP53ALDH1A1MAPK1PTK2B
SCHEMBL12493991 0.84 APLNR (0.49) APLNRTP53ALDH1A1MAPK1PTK2B
SCHEMBL12494428 0.84 APLNR (0.49) APLNRTP53ALDH1A1MAPK1PTK2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2683703-B1 NOVEL SUBSTITUTED PHENYL-OXATHIAZINE DERIVATIVES, METHOD FOR PRODUCING THEM, DRUGS CONTAINING SAID COMPOUNDS AND THE USE THEREOF SANOFI SA (FR) 2015-05-27 — — EP disclosed
EP-2683702-B1 NEW SUBSTITUTED PHENYL OXATHIAZINE DERIVATIVES, METHOD FOR THEIR MANUFACTURE, MEDICINES CONTAINING THESE COMPOUNDS AND THEIR APPLICATION SANOFI SA (FR) 2014-12-24 — — EP disclosed
EP-2683702-B1 NEW SUBSTITUTED PHENYL OXATHIAZINE DERIVATIVES, METHOD FOR THEIR MANUFACTURE, MEDICINES CONTAINING THESE COMPOUNDS AND THEIR APPLICATION SANOFI SA (FR) 2014-12-24 — — EP disclosed
US-8809324-B2 Substituted phenyl-oxathiazine derivatives, method for producing them, drugs containing said compounds and the use thereof SANOFI (FR) 2014-08-19 — — US disclosed
EP-2683703-A1 NOVEL SUBSTITUTED PHENYL-OXATHIAZINE DERIVATIVES, METHOD FOR PRODUCING THEM, DRUGS CONTAINING SAID COMPOUNDS AND THE USE THEREOF SANOFI (FR) 2014-01-15 — — EP disclosed
EP-2683702-A1 NOVEL SUBSTITUTED PHENYL-OXATHIAZINE DERIVATIVES, METHOD FOR PRODUCING THEM, DRUGS CONTAINING SAID COMPOUNDS AND THE USE THEREOF SANOFI (FR) 2014-01-15 — — EP disclosed
WO-2012120050-A1 NOVEL SUBSTITUTED PHENYL-OXATHIAZINE DERIVATIVES, METHOD FOR PRODUCING THEM, DRUGS CONTAINING SAID COMPOUNDS AND THE USE THEREOF SANOFI (FR) 2012-09-13 — — WO disclosed
WO-2012120050-A1 NOVEL SUBSTITUTED PHENYL-OXATHIAZINE DERIVATIVES, METHOD FOR PRODUCING THEM, DRUGS CONTAINING SAID COMPOUNDS AND THE USE THEREOF SANOFI (FR) 2012-09-13 — — WO disclosed
WO-2012120057-A1 NOVEL SUBSTITUTED PHENYL-OXATHIAZINE DERIVATIVES, METHOD FOR PRODUCING THEM, DRUGS CONTAINING SAID COMPOUNDS AND THE USE THEREOF SANOFI (FR) 2012-09-13 — — WO disclosed
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