SCHEMBL29993845

SCHEMBL29993845

c1cc(-c2nc3c4ccccc4c4ccccc4c3nc2-c2cccc(-c3cccc4c3sc3ccccc34)c2)cc(-c2cccc3c2sc2ccccc23)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 1/20 0.55
▸ PRKDC P78527 7/20 0.41
▸ DNPH1 O43598 1/20 0.40
▸ PARP14 Q460N5 1/20 0.39
▸ MAPT P10636 1/20 0.38
▸ LIMK1 P53667 4/20 0.37
▸ PIK3CD O00329 2/20 0.36
▸ PIK3CB P42338 2/20 0.36
▸ TNKS O95271 2/20 0.36
▸ TNKS2 Q9H2K2 2/20 0.36
▸ ATM Q13315 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ GPR3 P46089 1/20 0.35
▸ BRD4 O60885 1/20 0.34
▸ PIK3CA P42336 1/20 0.34
▸ MTOR P42345 1/20 0.34
▸ PIK3CG P48736 1/20 0.34
▸ KCNH2 Q12809 1/20 0.34
▸ BRDT Q58F21 1/20 0.34
▸ F9 P00740 1/20 0.33

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
SCHEMBL2407747 0.97 ALOX5 (0.52) ALOX5PRKDCDNPH1PARP14MAPT
SCHEMBL18777386 0.96 ALOX5 (0.51) ALOX5PRKDCDNPH1PARP14MAPT
SCHEMBL19349659 0.96 ALOX5 (0.51) ALOX5PRKDCDNPH1PARP14MAPT
SCHEMBL12268433 0.95 ALOX5 (0.53) ALOX5PRKDCDNPH1PARP14MAPT
SCHEMBL18777371 0.94 ALOX5 (0.52) ALOX5PRKDCDNPH1PARP14MAPT
SCHEMBL12268643 0.94 ALOX5 (0.49) ALOX5PRKDCDNPH1PARP14MAPT
SCHEMBL14826879 0.92 ALOX5 (0.49) ALOX5PRKDCDNPH1PARP14MAPT
SCHEMBL18777397 0.91 ALOX5 (0.49) ALOX5PRKDCDNPH1PARP14MAPT
SCHEMBL18777383 0.91 ALOX5 (0.49) ALOX5PRKDCDNPH1PARP14MAPT
SCHEMBL12268548 0.91 ALOX5 (0.49) ALOX5PRKDCDNPH1PARP14MAPT

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
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
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