SCHEMBL3263010

SCHEMBL3263010

C=CCN(CC=C)c1ccc(N=Nc2ccc([N+](=O)[O-])cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP14 P50281 1/20 0.47
MAPT P10636 10/20 0.46
ALDH1A1 P00352 9/20 0.46
TDP1 Q9NUW8 5/20 0.46
GAA P10253 2/20 0.46
POLB P06746 2/20 0.46
MEN1 O00255 8/20 0.44
KMT2A Q03164 8/20 0.44
RAB9A P51151 5/20 0.44
MAPK1 P28482 5/20 0.44
NPC1 O15118 4/20 0.44
SMN1; SMN2 Q16637 4/20 0.44
TNNI3 P19429 1/20 0.44
TNNT2 P45379 1/20 0.44
TNNC1 P63316 1/20 0.44
KEAP1 Q14145 1/20 0.44
NFE2L2 Q16236 1/20 0.44
HSP90AA1 P07900 2/20 0.42
AGTR1 P30556 1/20 0.42
HTT P42858 3/20 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
SCHEMBL3263007 1.00 MMP14 (0.47) MMP14MAPTALDH1A1TDP1GAA
SCHEMBL129460 0.91 ALDH1A1 (0.48) MAPTALDH1A1TDP1MEN1KMT2A
SCHEMBL8611406 0.89 ALDH1A1 (0.56) MMP14MAPTALDH1A1TDP1GAA
SCHEMBL876382 0.85 MMP14 (0.57) MMP14MAPTALDH1A1TDP1GAA
SCHEMBL876383 0.85 MMP14 (0.57) MMP14MAPTALDH1A1TDP1GAA
SCHEMBL8616387 0.85 ALDH1A1 (0.60) MMP14MAPTALDH1A1TDP1GAA
SCHEMBL8611566 0.85 MAPT (0.44) MMP14MAPTALDH1A1TDP1GAA
SCHEMBL8610429 0.83 MAPT (0.50) MAPTALDH1A1MEN1KMT2ARAB9A
SCHEMBL8610431 0.83 MAPT (0.50) MAPTALDH1A1MEN1KMT2ARAB9A
SCHEMBL887932 0.80 MMP14 (0.52) MMP14MAPTALDH1A1TDP1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100055353-A1 COMPOSITION COMPRISING CURABLE DICHROIC DYE FOR FORMING OPTICAL COMPONENT AND AN OPTICAL COMPONENT PRERARED USING THE SAME LG CHEM, LTD. (KR) 2010-03-04 US claimed
WO-2009005330-A2 COMPOSITION COMPRISING CURABLE DICHROIC DYE FOR FORMING PTICAL COMPONENT AND AN OPTICAL COMPONENT PREPARED USING THE SAME LG CHEM, LTD. (KR) 2009-01-08 WO claimed
US-8545717-B2 Composition comprising curable dichroic dye for forming optical component and an optical component prepared using the same LG CHEM, LTD. (KR) 2013-10-01 US disclosed
US-20100055353-A1 COMPOSITION COMPRISING CURABLE DICHROIC DYE FOR FORMING OPTICAL COMPONENT AND AN OPTICAL COMPONENT PRERARED USING THE SAME LG CHEM, LTD. (KR) 2010-03-04 US disclosed
WO-2009005330-A2 COMPOSITION COMPRISING CURABLE DICHROIC DYE FOR FORMING PTICAL COMPONENT AND AN OPTICAL COMPONENT PREPARED USING THE SAME LG CHEM, LTD. (KR) 2009-01-08 WO disclosed
EP-0350112-B1 POLYURETHANES PREPARED FROM NON-LINEAR OPTICAL ACTIVE DIOLS Akzo Nobel N.V. (NL) 1993-10-06 EP disclosed
US-5001209-A Non-linear optical active diols and polyurethanes prepared therefrom AKZO N.V. (NL) 1991-03-19 US disclosed
EP-0350112-A1 Polyurethanes prepared from non-linear optical active diols Akzo Nobel N.V. (NL) 1990-01-10 EP disclosed