SCHEMBL12494013

SCHEMBL12494013

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

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 1/20 0.50
▸ APLNR P35414 1/20 0.49
▸ TP53 P04637 1/20 0.48
▸ ALDH1A1 P00352 2/20 0.47
▸ MAPK1 P28482 1/20 0.47
▸ PTK2B Q14289 1/20 0.47
▸ MAOB P27338 1/20 0.44
▸ HTR2A P28223 1/20 0.44
▸ HTR2C P28335 1/20 0.44
▸ PARP15 Q460N3 1/20 0.43
▸ LMNA P02545 1/20 0.43
▸ HPGD P15428 1/20 0.43
▸ MEN1 O00255 2/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ KDM4E B2RXH2 1/20 0.42
▸ CYP19A1 P11511 1/20 0.42
▸ HTT P42858 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
SCHEMBL12492637 0.90 HTR2A (0.46) SMN1; SMN2APLNRTP53ALDH1A1MAOB
SCHEMBL12493897 0.86 APLNR (0.52) SMN1; SMN2APLNRTP53ALDH1A1MAPK1
SCHEMBL12494016 0.86 ALDH1A1 (0.62) SMN1; SMN2APLNRTP53ALDH1A1MAPK1
SCHEMBL12494308 0.86 SMN1; SMN2 (0.66) SMN1; SMN2APLNRTP53ALDH1A1MAPK1
SCHEMBL12493512 0.83 MRGPRX4 (0.53) SMN1; SMN2APLNRTP53ALDH1A1MAPK1
SCHEMBL12493367 0.83 SMN1; SMN2 (0.52) SMN1; SMN2APLNRTP53ALDH1A1MAPK1
SCHEMBL12493445 0.82 MAOB (0.53) SMN1; SMN2TP53ALDH1A1MAPK1PTK2B
SCHEMBL30714247 0.81 APLNR (0.49) SMN1; SMN2APLNRTP53MAOBHTR2A
SCHEMBL12493420 0.80 ALDH1A1 (0.55) SMN1; SMN2APLNRTP53ALDH1A1MAPK1
SCHEMBL12494198 0.80 SMN1; SMN2 (0.45) SMN1; SMN2APLNRTP53ALDH1A1MAPK1

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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