SCHEMBL29009583

SCHEMBL29009583

c1cnc(-c2nc(-c3cnccn3)c(-c3cnccn3)nc2-c2cnccn2)cn1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NISCH Q9Y2I1 1/20 0.43
HSP90AA1 P07900 1/20 0.42
METAP2 P50579 1/20 0.41
ADORA2A P29274 1/20 0.41
ADORA1 P30542 1/20 0.41
HTT P42858 1/20 0.40
RECQL P46063 1/20 0.40
CYP1A2 P05177 1/20 0.39
NPC1 O15118 1/20 0.38
PKM P14618 1/20 0.38
RAB9A P51151 1/20 0.38
CYP2D6 P10635 1/20 0.37
CYP19A1 P11511 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
HDAC1 Q13547 1/20 0.37
HDAC8 Q9BY41 1/20 0.37
HDAC6 Q9UBN7 1/20 0.37
PIK3CD O00329 1/20 0.37
PIK3CA P42336 1/20 0.37

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
SCHEMBL28540095 0.86 NISCH (0.45) NISCHHSP90AA1METAP2ADORA2AADORA1
SCHEMBL78566 0.82 NISCH (0.50) NISCHHSP90AA1METAP2HTTRECQL
SCHEMBL29454745 0.82 NISCH (0.50) NISCHHSP90AA1METAP2HTTRECQL
SCHEMBL29598957 0.82 NISCH (0.50) NISCHHSP90AA1METAP2HTTRECQL
SCHEMBL12120405 0.82 NISCH (0.36) NISCHHSP90AA1METAP2ADORA2AADORA1
Hydrochloric Acid SCHEMBL3640139 0.79 NISCH (0.48) NISCHHSP90AA1METAP2HTTRECQL
SCHEMBL31372462 0.79 NISCH (0.48) NISCHHSP90AA1METAP2HTTRECQL
SCHEMBL14053846 0.79 NISCH (0.48) NISCHHSP90AA1METAP2HTTRECQL
SCHEMBL9794662 0.79 NISCH (0.48) NISCHHSP90AA1METAP2HTTRECQL
SCHEMBL4780009 0.78 NPC1 (0.46) NISCHHSP90AA1METAP2ADORA2AADORA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116266033-A Photosensitive coloring composition for blue color filter, solid-state imaging element, and liquid crystal display device 东洋油墨SC控股株式会社 2023-06-20 CN disclosed
CN-116256942-A Photosensitive coloring composition, color filter, image display device, and solid-state imaging element 东洋油墨SC控股株式会社 2023-06-13 CN disclosed
CN-115981098-A Photosensitive composition, cured film using same, optical filter, image display device, and solid-state imaging element 东洋油墨SC控股株式会社 2023-04-18 CN disclosed