SCHEMBL2300476

SCHEMBL2300476

CCN(CC)CCCOc1ccc2sc3ccccc3c(=O)c2c1

nearest known ligand 0.61

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
XDH P47989 2/20 0.61
MAOA P21397 12/20 0.59
MAOB P27338 12/20 0.59
KDM4E B2RXH2 1/20 0.58
NPC1 O15118 1/20 0.58
ALDH1A1 P00352 1/20 0.58
MAPT P10636 1/20 0.58
RAB9A P51151 1/20 0.58
TDP1 Q9NUW8 1/20 0.58
L3MBTL1 Q9Y468 1/20 0.58
SIGMAR1 Q99720 1/20 0.51
ALK Q9UM73 1/20 0.51

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
SCHEMBL4207969 0.94 MAPT (0.59) XDHMAOAMAOBKDM4ENPC1
SCHEMBL1796580 0.94 XDH (0.57) XDHMAOAMAOBKDM4ENPC1
Hydrochloric Acid SCHEMBL4213278 0.93 MAPT (0.58) XDHMAOAMAOBKDM4ENPC1
SCHEMBL12795338 0.92 MAOA (0.56) XDHMAOAMAOBKDM4ENPC1
SCHEMBL1796441 0.91 XDH (0.56) XDHMAOAMAOBKDM4ENPC1
SCHEMBL21084279 0.88 MAOB (0.53) XDHMAOAMAOBKDM4ENPC1
SCHEMBL20124806 0.88 MAOA (0.55) XDHMAOAMAOBKDM4ENPC1
SCHEMBL12795334 0.87 MAOA (0.50) XDHMAOAMAOBKDM4ENPC1
SCHEMBL1794894 0.87 MAPT (0.57) XDHMAOBMAPTSIGMAR1ALK
SCHEMBL1794732 0.86 XDH (0.60) XDHMAOAMAOBKDM4EMAPT

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 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7740482-B2 Stable cationically crosslinkable/polymerizable dental composition with a high filler content BLUESTAR SILICONES FRANCE (FR) 2010-06-22 US claimed
EP-1745083-B1 HIGHLY-CHARGED STABLE DENTAL COMPOSITION WHICH MAY BE CROSS-LINKED/POLYMERISED BY CATIONIC REACTION BLUESTAR SILICONES FRANCE (FR) 2009-12-16 EP claimed
US-20080287562-A1 Stable cationically crosslinkable/polymerizable dental composition with a high filler content RHODIA CHIMIE (FR) 2008-11-20 US claimed
EP-1745083-A1 HIGHLY-CHARGED STABLE DENTAL COMPOSITION WHICH MAY BE CROSS-LINKED/POLYMERISED BY CATIONIC REACTION Rhodia Chimie (FR) 2007-01-24 EP claimed
WO-2005121200-A1 HIGHLY-CHARGED STABLE DENTAL COMPOSITION WHICH MAY BE CROSS-LINKED/POLYMERISED BY CATIONIC REACTION RHODIA CHIMIE (FR) 2005-12-22 WO claimed
US-20050261390-A1 Stable cationically crosslinkable/polymerizable dental composition with a high filler content RHODIA CHIMIE (FR) 2005-11-24 US claimed
US-8916624-B2 Dental compositions crosslinkable/polymerizable by cationic process BLUESTAR SILICONES FRANCE SAS (FR) 2014-12-23 US disclosed
US-8227047-B2 Radiation curable inkjet fluids and inks improved for photoyellowing AGFA GRAPHICS NV (BE) 2012-07-24 US disclosed
US-8227047-B2 Radiation curable inkjet fluids and inks improved for photoyellowing AGFA GRAPHICS NV (BE) 2012-07-24 US disclosed
US-20110189632-A1 DENTAL COMPOSITIONS CROSSLINKABLE/POLYMERIZABLE BY CATIONIC PROCESS BLUESTAR SILICONES FRANCE (FR) 2011-08-04 US disclosed
US-20100330296-A1 RADIATION CURABLE INKJET FLUIDS AND INKS IMPROVED FOR PHOTOYELLOWING AGFA GRAPHICS NV (BE) 2010-12-30 US disclosed
US-20100330296-A1 RADIATION CURABLE INKJET FLUIDS AND INKS IMPROVED FOR PHOTOYELLOWING AGFA GRAPHICS NV (BE) 2010-12-30 US disclosed
US-7740482-B2 Stable cationically crosslinkable/polymerizable dental composition with a high filler content BLUESTAR SILICONES FRANCE (FR) 2010-06-22 US disclosed
EP-2053102-A1 Radiation curable inkjet fluids and inks improved for photoyellowing Agfa Graphics N.V. (BE) 2009-04-29 EP disclosed
EP-2043588-A2 DENTAL COMPOSITION CROSSLINKABLE/POLYMERIZABLE BY CATIONIC PROCESS Bluestar Silicones France (FR) 2009-04-08 EP disclosed
US-20080287562-A1 Stable cationically crosslinkable/polymerizable dental composition with a high filler content RHODIA CHIMIE (FR) 2008-11-20 US disclosed
WO-2008009718-A2 DENTAL COMPOSITION CROSSLINKABLE/POLYMERIZABLE BY CATIONIC PROCESS BLUESTAR SILICONES FRANCE (FR) 2008-01-24 WO disclosed
EP-1745083-A1 HIGHLY-CHARGED STABLE DENTAL COMPOSITION WHICH MAY BE CROSS-LINKED/POLYMERISED BY CATIONIC REACTION Rhodia Chimie (FR) 2007-01-24 EP disclosed
WO-2005121200-A1 HIGHLY-CHARGED STABLE DENTAL COMPOSITION WHICH MAY BE CROSS-LINKED/POLYMERISED BY CATIONIC REACTION RHODIA CHIMIE (FR) 2005-12-22 WO disclosed
US-20050261390-A1 Stable cationically crosslinkable/polymerizable dental composition with a high filler content RHODIA CHIMIE (FR) 2005-11-24 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080287562-A1 Stable cationically crosslinkable/polymerizable dental composition with a high filler content RFC1, RFC2, HNRNPC XDH 3244/4885MAOA 1576/4885MAOB 710/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.