SCHEMBL8722337

SCHEMBL8722337

N#CC(C#N)=C(C#N)c1ccc(N(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.59
KMT2A Q03164 3/20 0.59
EGFR P00533 4/20 0.46
ALDH1A1 P00352 4/20 0.41
MAPT P10636 3/20 0.41
L3MBTL1 Q9Y468 3/20 0.41
CYP1A2 P05177 2/20 0.41
CYP2C9 P11712 2/20 0.41
CYP2C19 P33261 2/20 0.41
KDM4E B2RXH2 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
SLC16A3 O15427 1/20 0.36
SLC16A1 P53985 1/20 0.36
ESR1 P03372 1/20 0.35
CRHBP P24387 1/20 0.35
ATM Q13315 1/20 0.35
CRHR2 Q13324 1/20 0.35
TLR9 Q9NR96 1/20 0.35

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
SCHEMBL14744143 0.90 MEN1 (0.46) MEN1KMT2AALDH1A1MAPTL3MBTL1
SCHEMBL14744144 0.90 MEN1 (0.46) MEN1KMT2AALDH1A1MAPTL3MBTL1
SCHEMBL15494510 0.86 MEN1 (0.56) MEN1KMT2AEGFRALDH1A1MAPT
SCHEMBL18784036 0.85 MEN1 (0.51) MEN1KMT2AEGFRALDH1A1MAPT
SCHEMBL14746323 0.84 ESR1 (0.43) MEN1KMT2AALDH1A1MAPTL3MBTL1
SCHEMBL14746322 0.84 ESR1 (0.43) MEN1KMT2AALDH1A1MAPTL3MBTL1
SCHEMBL16760716 0.84 ESR1 (0.50) MEN1KMT2AALDH1A1MAPTL3MBTL1
SCHEMBL15494503 0.84 MEN1 (0.45) MEN1KMT2AEGFRALDH1A1MAPT
SCHEMBL6888049 0.83 MEN1 (0.43) MEN1KMT2AEGFRESR1
SCHEMBL15494352 0.82 MEN1 (0.40) MEN1KMT2AALDH1A1MAPTL3MBTL1

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
US-9104098-B2 Electrophotographic photosensitive member, process cartridge, and electrophotographic apparatus CANON KABUSHIKI KAISHA (JP) 2015-08-11 US disclosed
US-20140065531-A1 ELECTROPHOTOGRAPHIC PHOTOSENSITIVE MEMBER, PROCESS CARTRIDGE, AND ELECTROPHOTOGRAPHIC APPARATUS CANON KABUSHIKI KAISHA (JP) 2014-03-06 US disclosed
EP-2703891-A1 Electrophotographic photosensitive member, process cartridge, and electrophotographic apparatus Canon Kabushiki Kaisha (JP) 2014-03-05 EP disclosed
CN-1140935-C Molecular rectifier and its production process �Ϻ���ͨ��ѧ 2004-03-03 CN disclosed
CN-1341972-A Molecular rectifier and its production process UNIV FUDAN (CN) 2002-03-27 CN disclosed
EP-0868682-A1 ELECTRO- OR OPTO-OPTICAL DEVICE STABLE IN THE 600-1600 NANOMETER WAVELENGTH RANGE Akzo Nobel N.V. (NL) 1998-10-07 EP disclosed
WO-1997023807-A1 ELECTRO- OR OPTO-OPTICAL DEVICE STABLE IN THE 600-1600 NANOMETER WAVELENGTH RANGE AKZO NOBEL N.V. (NL) 1997-07-03 WO disclosed