SCHEMBL29808342

SCHEMBL29808342

Clc1nc(-c2ccccc2)nc(-c2ccc(-c3cccc4c3oc3ccccc34)cc2)n1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.50
MAPT P10636 8/20 0.43
ALDH1A1 P00352 5/20 0.42
POLB P06746 3/20 0.42
KDM4E B2RXH2 3/20 0.42
NPSR1 Q6W5P4 2/20 0.41
LMNA P02545 4/20 0.41
HPGD P15428 3/20 0.41
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
GAA P10253 1/20 0.41
GGPS1 O95749 1/20 0.40
TSHR P16473 4/20 0.39
HSD17B10 Q99714 3/20 0.39
MAPK1 P28482 2/20 0.39
PRKDC P78527 3/20 0.39
PIK3CD O00329 2/20 0.39
PIK3CB P42338 2/20 0.39
USP2 O75604 1/20 0.38
HTT P42858 1/20 0.38

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
SCHEMBL18463347 1.00 ALOX5 (0.50) ALOX5MAPTALDH1A1POLBKDM4E
SCHEMBL23770379 0.99 ALOX5 (0.49) ALOX5MAPTALDH1A1POLBKDM4E
SCHEMBL36126766 0.96 ALOX5 (0.46) ALOX5MAPTALDH1A1POLBKDM4E
SCHEMBL21707250 0.96 ALOX5 (0.46) ALOX5MAPTALDH1A1POLBKDM4E
SCHEMBL29603481 0.96 ALOX5 (0.45) ALOX5MAPTALDH1A1POLBKDM4E
SCHEMBL16636998 0.96 ALOX5 (0.45) ALOX5MAPTALDH1A1POLBKDM4E
SCHEMBL27284445 0.96 ALOX5 (0.51) ALOX5MAPTALDH1A1POLBKDM4E
SCHEMBL23080003 0.94 ALOX5 (0.52) ALOX5MAPTALDH1A1POLBKDM4E
SCHEMBL15501786 0.93 ALOX5 (0.56) ALOX5MAPTALDH1A1POLBKDM4E
SCHEMBL15501851 0.93 ALOX5 (0.56) ALOX5MAPTALDH1A1POLBKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111247652-B Organic light emitting device 株式会社LG化学 2024-01-05 CN disclosed
CN-110741002-B Heterocyclic compound and organic light-emitting device comprising same 株式会社LG化学 2023-12-05 CN disclosed
CN-110741001-B Heterocyclic compound and organic light-emitting device comprising same 株式会社LG化学 2023-09-26 CN disclosed
CN-113196515-B organic light emitting device 株式会社LG化学 2023-08-22 CN disclosed
CN-110291651-B Organic light-emitting element 株式会社LG化学 2023-07-18 CN disclosed
CN-110431679-B Organic light-emitting element 株式会社LG化学 2023-06-06 CN disclosed
CN-110622332-B Organic light emitting device 株式会社LG化学 2023-04-18 CN disclosed
CN-110462862-B Organic light emitting element 株式会社LG化学 2023-02-07 CN disclosed
CN-108290854-B Heterocyclic compound and organic light-emitting device comprising same 株式会社LG化学 2022-08-23 CN disclosed