SCHEMBL31055836

SCHEMBL31055836

c1ccc(-c2cccc(-c3ncccc3-c3ccc(-c4cccnc4-c4cccc(-c5ccccn5)n4)cc3)n2)nc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.62
CCR1 P32246 3/20 0.62
CCR5 P51681 3/20 0.62
CCR8 P51685 3/20 0.62
LMNA P02545 3/20 0.62
TP53 P04637 2/20 0.62
ALOX15 P16050 2/20 0.62
HTT P42858 2/20 0.62
SMN1; SMN2 Q16637 2/20 0.62
TDP1 Q9NUW8 2/20 0.62
L3MBTL1 Q9Y468 2/20 0.62
ALPL P05186 1/20 0.62
HSP90AA1 P07900 1/20 0.62
ALPI P09923 1/20 0.62
ALPG P10696 1/20 0.62
MAPK1 P28482 1/20 0.62
TGFBR1 P36897 9/20 0.50
CYP1A2 P05177 1/20 0.48
POLB P06746 1/20 0.48
METAP1 P53582 1/20 0.48

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
SCHEMBL5633776 0.95 KDM4E (0.56) KDM4ECCR1CCR5CCR8LMNA
SCHEMBL1368863 0.95 KDM4E (0.60) KDM4ECCR1CCR5CCR8LMNA
SCHEMBL21596186 0.92 CCR1 (0.53) KDM4ECCR1CCR5CCR8LMNA
SCHEMBL29827669 0.92 NPC1 (0.57) KDM4ECCR1CCR5CCR8LMNA
SCHEMBL5786082 0.92 KDM4E (0.53) KDM4ECCR1CCR5CCR8LMNA
SCHEMBL27938637 0.92 NPC1 (0.57) KDM4ECCR1CCR5CCR8LMNA
SCHEMBL8526559 0.92 CCR1 (0.53) KDM4ECCR1CCR5CCR8LMNA
SCHEMBL30662279 0.92 KDM4E (0.56) KDM4ECCR1CCR5CCR8LMNA
SCHEMBL5966400 0.89 KDM4E (0.49) KDM4ECCR1CCR5CCR8LMNA
SCHEMBL7964558 0.86 KDM4E (0.67) KDM4ECCR1CCR5CCR8LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111480245-B Light-emitting element, light-emitting device, electronic apparatus, and lighting device 株式会社半导体能源研究所 2025-06-24 CN disclosed
CN-112534344-B Electrochromic device of metal complex system 国立研究开发法人物质·材料研究机构 2024-08-20 CN disclosed