SCHEMBL27724751

SCHEMBL27724751

[Ir].c1ccc(-c2ccnc(-c3ccccc3)c2)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ASIC3 Q9UHC3 2/20 0.61
PIM1 P11309 1/20 0.51
SMO Q99835 2/20 0.50
TGFBR1 P36897 1/20 0.50
NOTUM Q6P988 1/20 0.48
PLAU P00749 1/20 0.47
GABRA1 P14867 1/20 0.47
GABRG2 P18507 1/20 0.47
GABRB3 P28472 1/20 0.47
GABRA5 P31644 1/20 0.47
GABRA3 P34903 1/20 0.47
CDK1 P06493 1/20 0.45
MAPKAPK2 P49137 1/20 0.45
MAPKAPK3 Q16644 1/20 0.45
MAPKAPK5 Q8IW41 1/20 0.45
MKNK1 Q9BUB5 1/20 0.45
MIF P14174 1/20 0.45
AURKA O14965 1/20 0.45
HSP90AA1 P07900 1/20 0.45
PRKACA P17612 1/20 0.45

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
SCHEMBL912763 0.98 ASIC3 (0.63) ASIC3PIM1SMOTGFBR1NOTUM
SCHEMBL29578028 0.98 ASIC3 (0.63) ASIC3PIM1SMOTGFBR1NOTUM
SCHEMBL24291931 0.95 ASIC3 (0.61) ASIC3PIM1SMOTGFBR1NOTUM
SCHEMBL29854571 0.95 ASIC3 (0.61) ASIC3PIM1SMOTGFBR1NOTUM
SCHEMBL17694751 0.95 ASIC3 (0.61) ASIC3PIM1SMOTGFBR1NOTUM
SCHEMBL29794052 0.95 ASIC3 (0.61) ASIC3PIM1SMOTGFBR1NOTUM
SCHEMBL21692157 0.95 ASIC3 (0.65) ASIC3PIM1SMOTGFBR1NOTUM
SCHEMBL3170518 0.91 NOTUM (0.62) ASIC3PIM1SMOTGFBR1NOTUM
SCHEMBL18905221 0.91 NOTUM (0.62) ASIC3PIM1SMOTGFBR1NOTUM
SCHEMBL417290 0.91 ASIC3 (0.54) ASIC3PIM1SMOTGFBR1NOTUM

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
CN-102185112-A Laminated organic light-emitting diode and preparation method thereof CHANGCHUN APPLIED CHEMISTRY 2011-09-14 CN claimed
CN-100490209-C Double phosphorescent dye co-doped white light organic electroluminescent device and method for fabricating the same CHANGCHUN APPLIED CHEMISTRY (CN) 2009-05-20 CN claimed
CN-101179116-A Double phosphorescent coloring agent common adulterate white light organic electroluminescent device and method for fabricating the same CHANGCHUN APPLIED CHEMISTRY (CN) 2008-05-14 CN claimed
CN-101859881-B Electronic transmission material, organic electroluminescent device and preparation method thereof CHANGCHUN APPLIED CHEMISTRY 2013-02-13 CN disclosed
CN-102185112-A Laminated organic light-emitting diode and preparation method thereof CHANGCHUN APPLIED CHEMISTRY 2011-09-14 CN disclosed
CN-101859881-A Electronic transmission material, organic electroluminescent device and preparation method thereof CHANGCHUN APPLIED CHEMISTRY 2010-10-13 CN disclosed
CN-100490209-C Double phosphorescent dye co-doped white light organic electroluminescent device and method for fabricating the same CHANGCHUN APPLIED CHEMISTRY (CN) 2009-05-20 CN disclosed
CN-101179116-A Double phosphorescent coloring agent common adulterate white light organic electroluminescent device and method for fabricating the same CHANGCHUN APPLIED CHEMISTRY (CN) 2008-05-14 CN disclosed