SCHEMBL6160673

SCHEMBL6160673

C=C(CCN(CCCC)CCCC)C(N)=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM5A P29375 4/20 0.41
THRA P10827 2/20 0.40
THRB P10828 2/20 0.40
CA12 O43570 2/20 0.39
CA1 P00915 2/20 0.39
CA9 Q16790 2/20 0.39
PHF8 Q9UPP1 2/20 0.39
KDM4C Q9H3R0 2/20 0.39
CYP1A2 P05177 2/20 0.36
CYP3A4 P08684 2/20 0.36
ICMT O60725 1/20 0.36
ALB P02768 1/20 0.36
LMNA P02545 1/20 0.36
CHRM2 P08172 1/20 0.36
HTR1A P08908 1/20 0.36
GAA P10253 1/20 0.36
CYP2D6 P10635 1/20 0.36
DRD3 P35462 1/20 0.36
SCN1A P35498 1/20 0.36
SLC6A3 Q01959 1/20 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
SCHEMBL25418558 0.93 ICMT (0.44) KDM5ATHRATHRBPHF8KDM4C
SCHEMBL9466183 0.92 KDM5A (0.41) KDM5ATHRATHRBCA12CA1
SCHEMBL5965045 0.88 CA12 (0.35) CA12CA9CYP1A2CYP2D6ALDH1A1
SCHEMBL28433809 0.87 KDM5A (0.41) KDM5ATHRATHRBCA12CA1
SCHEMBL8602675 0.85 KDM5A (0.34) KDM5ATHRATHRBCA12CA1
SCHEMBL8605318 0.83 KDM5A (0.40) KDM5ACA12CA1CA9PHF8
SCHEMBL3282614 0.82 KDM5A (0.46) KDM5ATHRATHRBCA12CA1
SCHEMBL127856 0.82 NPSR1 (0.35) LMNACHRM2CYP2D6ALDH1A1MEN1
SCHEMBL11161517 0.82 TDP1 (0.52) KDM5ATHRATHRBCA12CA1
SCHEMBL3288064 0.79 KDM5A (0.46) KDM5ATHRATHRBCA12CA1

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-1353992-B1 NOVEL POLYMER BINDER SYSTEMS COMPRISING IONIC LIQUIDS CREAVIS GES FUER TECHNOLOGIEUN (DE) 2005-02-09 EP disclosed
US-20040054041-A1 NOVEL POLYMER BINDER SYSTEMS COMPRISING IONIC LIQUIDS DEGUSSA AG (DE) 2004-03-18 US disclosed
EP-1353992-A1 NOVEL POLYMER BINDER SYSTEMS COMPRISING IONIC LIQUIDS Creavis Gesellschaft für Technologie und Innovation mbH (DE) 2003-10-22 EP disclosed
WO-2002053636-A1 NOVEL POLYMER BINDER SYSTEMS COMPRISING IONIC LIQUIDS CREAVIS GESELLSCHAFT FÜR TECHNOLOGIE UND INNOVATION MBH (DE) 2002-07-11 WO disclosed
WO-2002048275-A1 USE OF A BINDING SYSTEM CONSISTING OF (METH)ACRYLATE POLYMER COMPOSITIONS HAVING VARIABLE ELECTRICAL AND THERMAL PROPERTIES, AS A MATERIAL IN ELECTRICAL AND/OR ELECTRONIC COMPONENTS CREAVIS GESELLSCHAFT FÜR TECHNOLOGIE UND INNOVATION MBH (DE) 2002-06-20 WO disclosed
EP-0415055-B1 Water-soluble pressure-sensitive skin adhesive ROEHM GMBH (DE) 1994-12-14 EP disclosed
EP-0415055-A2 Water-soluble pressure-sensitive skin adhesive RÖHM GMBH (DE) 1991-03-06 EP disclosed