SCHEMBL23712115

SCHEMBL23712115

c1ccc(-c2cc(-c3ccc(-c4ccc5ccc6cccc7ccc4c5c67)c4ccccc34)cc(-c3ccccn3)n2)nc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.46
CCR1 P32246 3/20 0.46
CCR5 P51681 3/20 0.46
CCR8 P51685 3/20 0.46
HSP90AA1 P07900 2/20 0.46
LMNA P02545 2/20 0.46
TP53 P04637 2/20 0.46
MAPK1 P28482 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
ALPL P05186 1/20 0.46
ALPI P09923 1/20 0.46
ALPG P10696 1/20 0.46
ALOX15 P16050 1/20 0.46
HTT P42858 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
CYP1A2 P05177 4/20 0.41
AHR P35869 2/20 0.41
ERBB2 P04626 1/20 0.41
FYN P06241 1/20 0.41

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
SCHEMBL23712260 0.94 KDM4E (0.46) KDM4ECCR1CCR5CCR8HSP90AA1
SCHEMBL23712256 0.93 KDM4E (0.45) KDM4ECCR1CCR5CCR8HSP90AA1
SCHEMBL23712253 0.92 KDM4E (0.44) KDM4ECCR1CCR5CCR8HSP90AA1
SCHEMBL29342499 0.90 KDM4E (0.45) KDM4ECCR1CCR5CCR8HSP90AA1
SCHEMBL23711901 0.90 KDM4E (0.45) KDM4ECCR1CCR5CCR8HSP90AA1
SCHEMBL23712110 0.90 KDM4E (0.45) KDM4ECCR1CCR5CCR8HSP90AA1
SCHEMBL16483251 0.90 CCR1 (0.47) KDM4ECCR1CCR5CCR8HSP90AA1
SCHEMBL15446968 0.89 KDM4E (0.49) KDM4ECCR1CCR5CCR8HSP90AA1
SCHEMBL23711899 0.88 KDM4E (0.42) KDM4ECCR1CCR5CCR8HSP90AA1
SCHEMBL23712120 0.88 KDM4E (0.42) KDM4ECCR1CCR5CCR8HSP90AA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021152940-A1 COMPOUND, ORGANIC THIN-FILM LIGHT-EMITTING ELEMENT, DISPLAY DEVICE, AND ILLUMINATION DEVICE 東レ株式会社 2021-08-05 WO disclosed