SCHEMBL7769308

SCHEMBL7769308

CC(C)c1ccc2sc3ccccc3c(=O)c2c1.CCCOc1ccc(Cl)c2c(=O)c3ccccc3sc12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.40
MAPT P10636 7/20 0.39
NPC1 O15118 3/20 0.39
RAB9A P51151 3/20 0.39
HPGD P15428 2/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
ALDH1A1 P00352 4/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
TDP1 Q9NUW8 1/20 0.38
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
HCRTR1 O43613 2/20 0.37
NFKB1 P19838 1/20 0.37
NFKB2 Q00653 1/20 0.37
RELA Q04206 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
MAOA P21397 5/20 0.36

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
SCHEMBL4330332 0.88 KDM4E (0.55) KDM4EMAPTNPC1RAB9AHPGD
SCHEMBL13737882 0.87 MAPT (0.48) KDM4EMAPTNPC1RAB9AHPGD
SCHEMBL108341 0.87 MAPT (0.43) KDM4EMAPTNPC1RAB9AHPGD
SCHEMBL29353913 0.87 MAPT (0.43) KDM4EMAPTNPC1RAB9AHPGD
SCHEMBL29428465 0.87 MAPT (0.43) KDM4EMAPTNPC1RAB9AHPGD
SCHEMBL84110 0.85 MAPT (0.35) KDM4EMAPTNPC1RAB9AHPGD
SCHEMBL28557156 0.81 MAPT (0.42) MAPTNPC1RAB9AHPGDCYP1A2
SCHEMBL27432149 0.80 TNF (0.31) RARARXRARXRBRXRG
SCHEMBL1615173 0.80 CYP2C9 (0.41) MAPTNPC1RAB9AHPGDCYP1A2
SCHEMBL3159488 0.80 CYP2C9 (0.41) MAPTNPC1RAB9AHPGDCYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2912075-A1 CATIONICALLY CROSS-LINKABLE/POLYMERISABLE COMPOSITION COMPRISING AN IODONIUM BORATE AND RELEASING AN ACCEPTABLE ODOUR Bluestar Silicones France SAS (FR) 2015-09-02 EP disclosed
EP-2904021-A1 CATIONICALLY CROSS-LINKABLE/POLYMERIZABLE ORGANIC RESIN COMPOSITION COMPRISING AN IODONIUM BORATE AND HAVING AN ACCEPTABLE SMELL Bluestar Silicones France SAS (FR) 2015-08-12 EP disclosed
WO-2014053714-A1 CATIONICALLY CROSS-LINKABLE/POLYMERISABLE COMPOSITION COMPRISING AN IODONIUM BORATE AND RELEASING AN ACCEPTABLE ODOUR BLUESTAR SILICONES FRANCE SAS (FR) 2014-04-10 WO disclosed
WO-2014053231-A1 CATIONICALLY CROSS-LINKABLE/POLYMERIZABLE ORGANIC RESIN COMPOSITION COMPRISING AN IODONIUM BORATE AND HAVING AN ACCEPTABLE SMELL BLUESTAR SILICONES FRANCE SAS (FR) 2014-04-10 WO disclosed
EP-1117368-A1 DENTAL COMPOSITION BASED ON SILICONE CROSSLINKABLE BY CATION PROCESS RHODIA CHIMIE (FR) 2001-07-25 EP disclosed
WO-2000019967-A1 DENTAL COMPOSITION BASED ON SILICONE CROSSLINKABLE BY CATION PROCESS RHODIA CHIMIE (FR) 2000-04-13 WO disclosed