SCHEMBL12492802

SCHEMBL12492802

COc1ccc(CNS(=O)(=O)Cc2ccc(-c3ccccc3)cc2)c(OC)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.54
▸ MAPK1 P28482 1/20 0.54
▸ PTK2B Q14289 1/20 0.54
▸ MEN1 O00255 3/20 0.51
▸ KMT2A Q03164 3/20 0.51
▸ TAS1R3 Q7RTX0 2/20 0.51
▸ TAS1R1 Q7RTX1 2/20 0.51
▸ APLNR P35414 1/20 0.50
▸ TP53 P04637 2/20 0.49
▸ HTT P42858 1/20 0.46
▸ KDM4E B2RXH2 2/20 0.45
▸ POLB P06746 1/20 0.45
▸ MAPT P10636 1/20 0.45
▸ PTGER4 P35408 1/20 0.44
▸ CNR1 P21554 1/20 0.44
▸ USP2 O75604 2/20 0.44
▸ CYP1A2 P05177 2/20 0.44
▸ CYP3A4 P08684 2/20 0.44
▸ CYP2D6 P10635 2/20 0.44
▸ CYP2C9 P11712 2/20 0.44

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
SCHEMBL12494016 0.92 ALDH1A1 (0.62) ALDH1A1MAPK1PTK2BMEN1KMT2A
SCHEMBL12493420 0.88 ALDH1A1 (0.55) ALDH1A1MAPK1PTK2BMEN1KMT2A
SCHEMBL12494088 0.85 APLNR (0.52) ALDH1A1MAPK1PTK2BMEN1KMT2A
SCHEMBL12493897 0.85 APLNR (0.52) ALDH1A1MAPK1PTK2BMEN1KMT2A
SCHEMBL12493486 0.84 L3MBTL1 (0.54) ALDH1A1MAPK1PTK2BMEN1KMT2A
SCHEMBL12493991 0.82 APLNR (0.49) ALDH1A1MAPK1PTK2BMEN1KMT2A
SCHEMBL12494428 0.82 APLNR (0.49) ALDH1A1MAPK1PTK2BMEN1KMT2A
SCHEMBL12700064 0.82 APLNR (0.49) ALDH1A1MAPK1PTK2BMEN1KMT2A
SCHEMBL12492811 0.81 ALDH1A1 (0.53) ALDH1A1MAPK1PTK2BMEN1KMT2A
SCHEMBL12493445 0.81 MAOB (0.53) ALDH1A1MAPK1PTK2BTP53TDP1

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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