SCHEMBL29986900

SCHEMBL29986900

c1ccc2c(c1)[nH]c1c2ccc2c3ccccc3oc21

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 5/20 0.50
GABRP O00591 2/20 0.49
GABRD O14764 2/20 0.49
GABRA1 P14867 2/20 0.49
GABRB1 P18505 2/20 0.49
GABRG2 P18507 2/20 0.49
GABRB3 P28472 2/20 0.49
GABRA5 P31644 2/20 0.49
GABRA3 P34903 2/20 0.49
GABRA2 P47869 2/20 0.49
GABRB2 P47870 2/20 0.49
GABRA4 P48169 2/20 0.49
GABRE P78334 2/20 0.49
GABRA6 Q16445 2/20 0.49
GABRG1 Q8N1C3 2/20 0.49
GABRG3 Q99928 2/20 0.49
GABRQ Q9UN88 2/20 0.49
ALDH1A1 P00352 3/20 0.45
HSD17B10 Q99714 2/20 0.45
GPR3 P46089 1/20 0.45

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
SCHEMBL29506374 1.00 KIF11 (0.50) KIF11GABRPGABRDGABRA1GABRB1
SCHEMBL28416978 1.00 KIF11 (0.50) KIF11GABRPGABRDGABRA1GABRB1
SCHEMBL1635623 1.00 KIF11 (0.50) KIF11GABRPGABRDGABRA1GABRB1
SCHEMBL25703399 0.91 CYP1A2 (0.46) KIF11GABRPGABRDGABRA1GABRB1
SCHEMBL25703812 0.89 ERCC5 (0.47) ALDH1A1HSD17B10ERCC5FEN1MAPT
SCHEMBL7499024 0.87 ERCC5 (0.50) KIF11GABRPGABRDGABRA1GABRB1
SCHEMBL15796884 0.85 KIF11 (0.51) KIF11GABRPGABRDGABRA1GABRB1
SCHEMBL24013313 0.84 AHR (0.54) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL24558366 0.84 KIF11 (0.54) KIF11GABRPGABRDGABRA1GABRB1
SCHEMBL15126728 0.84 MEN1 (0.44) ALDH1A1HSD17B10ERCC5FEN1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122094304-A Organic electroluminescent device and electronic device 2026-05-26 CN disclosed
CN-122080005-A Organic material, organic electroluminescent device and electronic device 2026-05-26 CN disclosed
CN-119330991-A Light emitting element, polycyclic compound for use in the same, and display device including the same 三星显示有限公司 2025-01-21 CN disclosed
CN-119302067-A Organic electroluminescent element, compound, and electronic device 出光兴产株式会社 2025-01-10 CN disclosed
CN-112898325-B Compound and application thereof, and organic electroluminescent device comprising compound 北京鼎材科技有限公司 2024-11-26 CN disclosed
CN-110862378-B Heterocyclic compound and organic light-emitting device 三星电子株式会社 2024-11-15 CN disclosed
WO-2024111923-A1 ORGANIC LIGHT-EMITTING DEVICE, AND COMPOSITION FOR FORMING ORGANIC MATERIAL LAYER 엘티소재주식회사 2024-05-30 WO disclosed
CN-117412978-A Compound, material for organic electroluminescent element, and electronic device 出光兴产株式会社 2024-01-16 CN disclosed
CN-117203213-A Organic molecules for optoelectronic devices 三星显示有限公司 2023-12-08 CN disclosed
CN-116998254-A Organic electroluminescent element, compound, and electronic device 出光兴产株式会社 2023-11-03 CN disclosed
CN-116253753-A Luminescent material, application thereof and organic electroluminescent device comprising luminescent material 清华大学 2023-06-13 CN disclosed
WO-2022250228-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING SAME 엘티소재주식회사 2022-12-01 WO disclosed