SCHEMBL28663752

SCHEMBL28663752

[c]1cccc(-c2nc(-c3ccccc3)nc(-c3ccccc3)n2)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.50
ADORA2A P29274 5/20 0.45
ADORA1 P30542 5/20 0.45
ADORA3 P0DMS8 3/20 0.45
ADORA2B P29275 3/20 0.45
POLB P06746 1/20 0.45
MEN1 O00255 6/20 0.42
KMT2A Q03164 6/20 0.42
ALDH1A1 P00352 2/20 0.42
MAPT P10636 2/20 0.42
HPGD P15428 2/20 0.42
NPC1 O15118 3/20 0.42
RAB9A P51151 3/20 0.42
MAPK1 P28482 1/20 0.42
HTT P42858 2/20 0.41
NTSR1 P30989 1/20 0.38
ALOX15 P16050 1/20 0.38
TSHR P16473 1/20 0.38
NR1H4 Q96RI1 1/20 0.38
LMNA P02545 3/20 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
SCHEMBL28644170 0.89 TSHR (0.42) L3MBTL1ADORA2AADORA1ADORA3ADORA2B
SCHEMBL9957555 0.86 MEN1 (0.52) L3MBTL1ADORA2AADORA1MEN1KMT2A
SCHEMBL9957274 0.80 MAOB (0.39) L3MBTL1ADORA2AADORA1POLBMEN1
SCHEMBL713782 0.79 L3MBTL1 (0.56) L3MBTL1ADORA2AADORA1ADORA3ADORA2B
SCHEMBL2960 0.79 ALDH1A1 (0.50) ALDH1A1MAPTNPC1RAB9AMAPK1
SCHEMBL371042 0.78 L3MBTL1 (0.74) L3MBTL1ADORA2AADORA1ADORA3ADORA2B
SCHEMBL9957627 0.78 LMNA (0.46) L3MBTL1MEN1KMT2AMAPTHPGD
SCHEMBL2448213 0.77 ALDH1A1 (0.47) ALDH1A1MAPTMAPK1HTTTSHR
SCHEMBL24983 0.77 ALDH1A1 (0.47) ALDH1A1MAPTMAPK1HTTTSHR
SCHEMBL160790 0.76 CYP2A6 (0.45) NPC1RAB9ANFKB1NFKB2RELA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113710662-B Heterocyclic compound and organic light-emitting device including the same LT素材株式会社 2024-06-18 CN disclosed
CN-117143034-A Organic compound, organic photoelectric element containing same and application 上海大学 2023-12-01 CN disclosed
CN-115336028-A Composition for light-emitting device, light-emitting apparatus, electronic device, and lighting apparatus 株式会社半导体能源研究所 2022-11-11 CN disclosed
CN-113710662-A Heterocyclic compound and organic light-emitting device including same LT素材株式会社 2021-11-26 CN disclosed
CN-113631556-A Compound, and organic semiconductor layer, organic electronic device, and display device or lighting device comprising same 诺瓦尔德股份有限公司 2021-11-09 CN disclosed