SCHEMBL12493445

SCHEMBL12493445

COc1ccc(CNS(=O)(=O)Cc2cccc(OCc3ccccc3)c2)c(OC)c1

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 3/20 0.53
▸ BCHE P06276 5/20 0.52
▸ TDP1 Q9NUW8 1/20 0.51
▸ ALDH1A1 P00352 2/20 0.49
▸ MAPK1 P28482 1/20 0.49
▸ PTK2B Q14289 1/20 0.49
▸ TP53 P04637 1/20 0.47
▸ ABCB1 P08183 1/20 0.47
▸ HTR1A P08908 1/20 0.47
▸ DRD2 P14416 1/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.47
▸ PPARA Q07869 1/20 0.47

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
SCHEMBL12493420 0.92 ALDH1A1 (0.55) MAOBBCHETDP1ALDH1A1MAPK1
SCHEMBL12494016 0.87 ALDH1A1 (0.62) TDP1ALDH1A1MAPK1PTK2BTP53
SCHEMBL12494013 0.82 SMN1; SMN2 (0.50) MAOBALDH1A1MAPK1PTK2BTP53
SCHEMBL12494308 0.82 SMN1; SMN2 (0.66) ALDH1A1MAPK1PTK2BTP53SMN1; SMN2
SCHEMBL12493512 0.81 MRGPRX4 (0.53) TDP1ALDH1A1MAPK1PTK2BTP53
SCHEMBL12492802 0.81 ALDH1A1 (0.54) TDP1ALDH1A1MAPK1PTK2BTP53
SCHEMBL12492811 0.79 ALDH1A1 (0.53) TDP1ALDH1A1MAPK1PTK2BTP53
SCHEMBL12493367 0.79 SMN1; SMN2 (0.52) TDP1ALDH1A1MAPK1PTK2BTP53
SCHEMBL12700064 0.77 APLNR (0.49) MAOBTDP1ALDH1A1MAPK1PTK2B
SCHEMBL14416964 0.77 MAOB (0.53) MAOBBCHEALDH1A1PPARA

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 7 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-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
US-8895547-B2 Substituted phenyl-oxathiazine derivatives, method for producing them, drugs containing said compounds and the use thereof SANOFI (FR) 2014-11-25 — — US disclosed
US-8895547-B2 Substituted phenyl-oxathiazine derivatives, method for producing them, drugs containing said compounds and the use thereof SANOFI (FR) 2014-11-25 — — 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
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
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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