SCHEMBL6534856

SCHEMBL6534856

CCCCN(CCCC)c1ccccc1C=NN(c1ccccc1)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.48
MAPT P10636 2/20 0.48
MAPK1 P28482 2/20 0.48
HTT P42858 1/20 0.48
POLB P06746 2/20 0.43
EIF4H Q15056 1/20 0.43
USP2 O75604 1/20 0.38
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
TDP1 Q9NUW8 3/20 0.34
DHFR P00374 2/20 0.34
ALDH1A1 P00352 2/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
IDO1 P14902 1/20 0.33
NR1H2 P55055 1/20 0.33

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
SCHEMBL6534854 1.00 GAA (0.48) GAAMAPTMAPK1HTTPOLB
SCHEMBL5667351 0.91 MAPT (0.50) GAAMAPTMAPK1HTTPOLB
SCHEMBL5667349 0.91 MAPT (0.50) GAAMAPTMAPK1HTTPOLB
SCHEMBL942292 0.86 MAPT (0.61) GAAMAPTMAPK1HTTPOLB
SCHEMBL30769484 0.86 MAPT (0.61) GAAMAPTMAPK1HTTPOLB
SCHEMBL942294 0.86 MAPT (0.61) GAAMAPTMAPK1HTTPOLB
SCHEMBL10899994 0.80 MAPT (0.58) GAAMAPTMAPK1HTTPOLB
SCHEMBL10899990 0.80 MAPT (0.58) GAAMAPTMAPK1HTTPOLB
SCHEMBL1703027 0.78 GAA (0.46) GAAMAPTMAPK1HTTUSP2
SCHEMBL1703028 0.78 GAA (0.46) GAAMAPTMAPK1HTTUSP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1073935-A4 DUAL LAYER PHOTOCONDUCTORS WITH CHARGE GENERATION LAYER CONTAINING CHARGE TRANSPORT COMPOUND LEXMARK INT INC (US) 2004-10-27 EP disclosed
EP-1073935-A1 DUAL LAYER PHOTOCONDUCTORS WITH CHARGE GENERATION LAYER CONTAINING CHARGE TRANSPORT COMPOUND Lexmark International, Inc. (US) 2001-02-07 EP disclosed
WO-1999056181-A1 DUAL LAYER PHOTOCONDUCTORS WITH CHARGE GENERATION LAYER CONTAINING CHARGE TRANSPORT COMPOUND LEXMARK INTERNATIONAL, INC. (US) 1999-11-04 WO disclosed
EP-0149914-B1 OVERCOATED ELECTROPHOTOGRAPHIC IMAGING MEMBER XEROX CORPORATION (US) 1988-08-10 EP disclosed