SCHEMBL12493486

SCHEMBL12493486

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

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 1/20 0.54
▸ MEN1 O00255 3/20 0.50
▸ KMT2A Q03164 3/20 0.50
▸ HSD17B10 Q99714 1/20 0.49
▸ PTGS1 P23219 1/20 0.49
▸ AKR1C3 P42330 1/20 0.49
▸ AKR1C2 P52895 1/20 0.49
▸ APLNR P35414 1/20 0.49
▸ ALDH1A1 P00352 2/20 0.48
▸ KDM4E B2RXH2 2/20 0.48
▸ GAA P10253 1/20 0.48
▸ TDP1 Q9NUW8 1/20 0.48
▸ TP53 P04637 1/20 0.48
▸ MAPK1 P28482 1/20 0.47
▸ PTK2B Q14289 1/20 0.47
▸ POLB P06746 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

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
SCHEMBL12494088 0.86 APLNR (0.52) MEN1KMT2AAPLNRALDH1A1TP53
SCHEMBL12494016 0.86 ALDH1A1 (0.62) L3MBTL1MEN1KMT2AAPLNRALDH1A1
SCHEMBL12493991 0.86 APLNR (0.49) MEN1KMT2AAPLNRALDH1A1TDP1
SCHEMBL12492802 0.84 ALDH1A1 (0.54) MEN1KMT2AAPLNRALDH1A1KDM4E
SCHEMBL12493897 0.84 APLNR (0.52) L3MBTL1MEN1KMT2AAPLNRALDH1A1
SCHEMBL12493420 0.82 ALDH1A1 (0.55) MEN1KMT2AAPLNRALDH1A1GAA
SCHEMBL12699984 0.81 GAA (0.57) MEN1KMT2AALDH1A1KDM4EGAA
SCHEMBL12700064 0.81 APLNR (0.49) MEN1KMT2AAPLNRALDH1A1TDP1
SCHEMBL12494428 0.81 APLNR (0.49) MEN1KMT2AAPLNRALDH1A1TP53
SCHEMBL12493512 0.81 MRGPRX4 (0.53) MEN1KMT2AAKR1C3APLNRALDH1A1

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 5 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
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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