SCHEMBL293593

SCHEMBL293593

C=C(C)C(=O)OOC(=O)NCC

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.44
THRB P10828 2/20 0.38
TSHR P16473 3/20 0.37
EPHX1 P07099 1/20 0.36
CHRNB2 P17787 1/20 0.33
CHRNB4 P30926 1/20 0.33
CHRNA3 P32297 1/20 0.33
CHRNA4 P43681 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.32
MMP1 P03956 1/20 0.31
MMP2 P08253 1/20 0.31
MMP3 P08254 1/20 0.31
MMP9 P14780 1/20 0.31
MMP8 P22894 1/20 0.31
KMT2A Q03164 3/20 0.31
MEN1 O00255 2/20 0.31
GAA P10253 2/20 0.30
KDM4E B2RXH2 1/20 0.30
POLB P06746 1/20 0.30
MAPT P10636 1/20 0.30

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
SCHEMBL9488324 0.81 ALDH1A1 (0.46) ALDH1A1THRBTSHREPHX1CHRNB2
SCHEMBL11544171 0.80 THRB (0.44) ALDH1A1THRBTSHREPHX1CHRNB2
SCHEMBL11544184 0.78 EPHX1 (0.35) ALDH1A1EPHX1CHRNB2CHRNB4CHRNA3
SCHEMBL2215339 0.76 ALDH1A1 (0.61) ALDH1A1THRBTSHRKMT2AMAPT
SCHEMBL890339 0.76 THRB (0.58) ALDH1A1THRBTSHRCHRNB2CHRNB4
SCHEMBL11548091 0.76 ALDH1A1 (0.50) ALDH1A1THRBTSHRCHRNB2CHRNA4
SCHEMBL27787390 0.74 ALDH1A1 (0.36) ALDH1A1TSHR
SCHEMBL18123490 0.73 TSHR (0.62) THRBTSHRCHRNB2CHRNB4CHRNA3
SCHEMBL15440677 0.73 EPHX1 (0.41) ALDH1A1THRBEPHX1CHRNB2CHRNB4
Hydrochloric Acid SCHEMBL9698983 0.72 EPHX1 (0.37) ALDH1A1THRBEPHX1CHRNB2CHRNB4

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-8617722-B2 Polymer compound and organic electroluminescence element using the same SHOWA DENKO K.K. (JP) 2013-12-31 US disclosed
EP-2059543-B1 ORGANIC ELECTROLUMINESCENCE ELEMENT AND USE THEREOF SHOWA DENKO KK (JP) 2012-03-14 EP disclosed
US-20100327738-A1 POLYMER COMPOUND AND ORGANIC ELECTROLUMINESCENCE ELEMENT USING THE SAME SHOWA DENKO K.K. (JP) 2010-12-30 US disclosed
EP-2246370-A1 POLYMER COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME SHOWA DENKO K.K. (JP) 2010-11-03 EP disclosed
US-20100264813-A1 ORGANIC ELECTROLUMINESCENCE ELEMENT AND USE THEREOF SHOWA DENKO K.K. (JP) 2010-10-21 US disclosed
EP-2059543-A1 ORGANIC ELECTROLUMINESCENCE ELEMENT AND USE THEREOF Showa Denko K.K. (JP) 2009-05-20 EP disclosed
WO-2008029935-A1 ORGANIC ELECTROLUMINESCENCE ELEMENT AND USE THEREOF SHOWA DENKO K.K. (JP) 2008-03-13 WO disclosed
US-4165266-A LIQUID MONOACRYLATE MONOMER AND A POLYVINYL ALKYL ETHER, QUICK STICKING UNION CARBIDE CORPORATION (US) 1979-08-21 US disclosed