SCHEMBL29742929

SCHEMBL29742929

c1ccc2c(c1)[nH]c1ccc(-c3cccc4[nH]c5ccccc5c34)cc12

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AHR P35869 2/20 0.52
▸ GABRP O00591 2/20 0.51
▸ GABRD O14764 2/20 0.51
▸ GABRA1 P14867 2/20 0.51
▸ GABRB1 P18505 2/20 0.51
▸ GABRG2 P18507 2/20 0.51
▸ GABRB3 P28472 2/20 0.51
▸ GABRA5 P31644 2/20 0.51
▸ GABRA3 P34903 2/20 0.51
▸ GABRA2 P47869 2/20 0.51
▸ GABRB2 P47870 2/20 0.51
▸ GABRA4 P48169 2/20 0.51
▸ GABRE P78334 2/20 0.51
▸ GABRA6 Q16445 2/20 0.51
▸ GABRG1 Q8N1C3 2/20 0.51
▸ GABRG3 Q99928 2/20 0.51
▸ GABRQ Q9UN88 2/20 0.51
▸ IMPDH2 P12268 1/20 0.49
▸ IMPDH1 P20839 1/20 0.49
▸ ALDH1A1 P00352 2/20 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
SCHEMBL18429999 1.00 AHR (0.52) AHRGABRPGABRDGABRA1GABRB1
SCHEMBL28368134 0.91 CDK4 (0.51) AHRGABRPGABRDGABRA1GABRB1
SCHEMBL17277906 0.90 IMPDH2 (0.49) AHRGABRPGABRDGABRA1GABRB1
SCHEMBL30441967 0.90 AHR (0.52) AHRGABRPGABRDGABRA1GABRB1
SCHEMBL28264576 0.90 AHR (0.52) AHRGABRPGABRDGABRA1GABRB1
SCHEMBL18429996 0.90 AHR (0.52) AHRGABRPGABRDGABRA1GABRB1
SCHEMBL26729883 0.87 IMPDH2 (0.53) AHRGABRPGABRDGABRA1GABRB1
SCHEMBL22065865 0.87 CHUK (0.60) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL29888691 0.87 CDK4 (0.55) AHRGABRPGABRDGABRA1GABRB1
SCHEMBL1669833 0.85 IMPDH2 (0.55) AHRGABRPGABRDGABRA1GABRB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111710788-B Light emitting element, display device, electronic device, and lighting device 株式会社半导体能源研究所 2023-07-21 — — CN disclosed
CN-111354874-B Light emitting element, display device, electronic device, and lighting device 株式会社半导体能源研究所 2023-07-04 — — CN disclosed
CN-111341927-B Light emitting element, display device, electronic device, and lighting device 株式会社半导体能源研究所 2023-06-09 — — CN disclosed
CN-114914374-A Light emitting device 三星显示有限公司 2022-08-16 — — CN disclosed
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