SCHEMBL1890145

SCHEMBL1890145

CCCCNCCCC.c1ccc(C(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 3/20 0.53
GRIN1 Q05586 2/20 0.52
GRIN2A Q12879 2/20 0.52
ALDH1A1 P00352 3/20 0.50
POLB P06746 1/20 0.50
MAPT P10636 1/20 0.50
KCNH2 Q12809 1/20 0.46
LMNA P02545 1/20 0.44
PAX8 Q06710 1/20 0.44
NAAA Q02083 2/20 0.44
KDM4E B2RXH2 1/20 0.42
HTR2A P28223 1/20 0.42
HRH1 P35367 1/20 0.42
TSHR P16473 1/20 0.42

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
SCHEMBL11594799 0.87 GRIN1 (0.45) SIGMAR1GRIN1GRIN2AALDH1A1POLB
SCHEMBL11584396 0.84 HTR2A (0.63) SIGMAR1GRIN1GRIN2AALDH1A1POLB
SCHEMBL9973173 0.82 GRIN1 (0.72) SIGMAR1GRIN1GRIN2AALDH1A1POLB
Phenylpropanol SCHEMBL27604041 0.81 LMNA (0.68) SIGMAR1GRIN1GRIN2AALDH1A1POLB
SCHEMBL11922992 0.81 KCNH2 (0.49) SIGMAR1GRIN1GRIN2AALDH1A1POLB
Biphenyl SCHEMBL7742046 0.80 SIGMAR1 (0.59) SIGMAR1ALDH1A1KDM4ETSHR
SCHEMBL9191899 0.80 ALDH1A1 (0.55) SIGMAR1GRIN1GRIN2AALDH1A1POLB
Benzene SCHEMBL8772852 0.79 TSHR (0.65) SIGMAR1ALDH1A1KDM4ETSHR
Isopropylbenzene SCHEMBL8668126 0.79 SIGMAR1 (0.58) SIGMAR1GRIN1GRIN2AALDH1A1NAAA
SCHEMBL7791795 0.79 TAAR1 (0.53) SIGMAR1GRIN1GRIN2AALDH1A1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8506695-B2 Matrix of oligomer of tripropylene glycol diacrylate, melamine acrylate, amine functional polyester acrylate, hexanediol diacrylate, dendritic polyester-based acrylate, and/or bisphenol-A epoxy diacrylate with activator dissolved ; 4,4*-dihydroxydiphenyl sulfone color former; leuco dye; packages HEWLETT-PACKARD DEVELOPMENT COMPANY, L.P. (US) 2013-08-13 US disclosed
US-8257906-B2 Multi-layered radiation imageable coating HEWLETT-PACKARD DEVELOPMENT COMPANY, L.P. (US) 2012-09-04 US disclosed
US-7935471-B2 NIR/IR curable coatings for light directed imaging HEWLETT-PACKARD DEVELOPMENT COMPANY, L.P. (US) 2011-05-03 US disclosed
US-7754413-B2 Color forming composition with enhanced image stability HEWLETT-PACKARD DEVELOPMENT COMPANY, L.P. (US) 2010-07-13 US disclosed
EP-1937489-B1 DUAL BAND COLOR FORMING COMPOSITION HEWLETT PACKARD DEVELOPMENT CO (US) 2009-10-14 EP disclosed
EP-2094498-A1 COLOR FORMING COMPOSITION CONTAINING A PLURALITY OF ANTENNA DYES Hewlett-Packard Development Company, L.P. (US) 2009-09-02 EP disclosed
US-7514198-B2 Color forming composition containing a plurality of antenna dyes HEWLETT-PACKARD DEVELOPMENT COMPANY, L.P. (US) 2009-04-07 US disclosed
US-7499073-B2 Optical disc and method of labeling the same HEWLETT-PACKARD DEVELOPMENT COMPANY, L.P. (US) 2009-03-03 US disclosed
EP-2010394-A1 COMPOSITIONS, SYSTEMS, AND METHODS FOR IMAGING Hewlett-Packard Development Company, L.P. (US) 2009-01-07 EP disclosed
WO-2008130930-A1 OPTICAL DISC AND METHOD OF LABELING THE SAME HEWLETT-PACKARD DEVELOPMENT COMPANY, L.P. (US) 2008-10-30 WO disclosed
US-20070238045-A1 Multi-layered radiation imageable coating HEWLETT-PACKARD DEVELOPMENT COMPANY 2007-10-11 US disclosed
US-20070212639-A1 Color forming composition with enhanced image stability HEWLETT-PACKARD DEVELOPMENT COMPANY, L.P. 2007-09-13 US disclosed
US-20070105039-A1 Dual band color forming composition HEWLETT-PACKARD DEVELOPMENT COMPANY, L.P. 2007-05-10 US disclosed
US-20070092828-A1 NIR/IR curable coatings for light directed imaging HEWLETT-PACKARD DEVELOPMENT COMPANY, L.P. 2007-04-26 US disclosed
WO-2007047932-A2 NIR/IR CURABLE COATINGS FOR LIGHT DIRECTED IMAGING HEWLETT-PACKARD DEVELOPMENT COMPANY, L.P. (US) 2007-04-26 WO disclosed
WO-2007046925-A1 DUAL BAND COLOR FORMING COMPOSITION HEWLETT-PACKARD DEVELOPMENT COMPANY, L.P. (US) 2007-04-26 WO disclosed
US-20070037088-A1 Thermochromic coating having improved marking sensitivity and shelf-life reliability; radiation curable polymer matrix and an activator, hybrid antenna dye package; optical discs HEWLETT-PACKARD DEVELOPMENT COMPANY, L.P. 2007-02-15 US disclosed
EP-0889363-B1 Near IR sensitive photoimageable/photopolymerizable compositions, media, and associated processes DU PONT (US) 2005-10-05 EP disclosed
US-6861201-B2 Near IR sensitive photoimageable/photopolymerizable compositions, media, and associated processes E. I. DU PONT DE NEMOURS AND COMPANY (US) 2005-03-01 US disclosed
EP-0889363-A1 Near IR sensitive photoimageable/photopolymerizable compositions, media, and associated processes E.I. DU PONT DE NEMOURS AND COMPANY (US) 1999-01-07 EP disclosed