SCHEMBL24765750

SCHEMBL24765750

Brc1ccc2[nH]c3cccc(-c4ccccc4)c3c2c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDK4 P11802 6/20 0.52
▸ CCND1 P24385 6/20 0.52
▸ GABRP O00591 1/20 0.48
▸ GABRD O14764 1/20 0.48
▸ GABRA1 P14867 1/20 0.48
▸ GABRB1 P18505 1/20 0.48
▸ GABRG2 P18507 1/20 0.48
▸ GABRB3 P28472 1/20 0.48
▸ GABRA5 P31644 1/20 0.48
▸ GABRA3 P34903 1/20 0.48
▸ GABRA2 P47869 1/20 0.48
▸ GABRB2 P47870 1/20 0.48
▸ GABRA4 P48169 1/20 0.48
▸ GABRE P78334 1/20 0.48
▸ GABRA6 Q16445 1/20 0.48
▸ GABRG1 Q8N1C3 1/20 0.48
▸ GABRG3 Q99928 1/20 0.48
▸ GABRQ Q9UN88 1/20 0.48
▸ ATM Q13315 1/20 0.48
▸ RXFP1 Q9HBX9 1/20 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
SCHEMBL19494764 0.84 CDK4 (0.56) CDK4CCND1GABRPGABRDGABRA1
SCHEMBL31664385 0.81 IMPDH2 (0.55) CDK4CCND1GABRPGABRDGABRA1
SCHEMBL1177888 0.81 IMPDH2 (0.55) CDK4CCND1GABRPGABRDGABRA1
SCHEMBL19998222 0.81 MEN1 (0.59) CDK4CCND1RXFP1CDK2CLK4
SCHEMBL31616441 0.81 MEN1 (0.59) CDK4CCND1RXFP1CDK2CLK4
SCHEMBL25556376 0.81 CDK4 (0.56) CDK4CCND1GABRPGABRDGABRA1
SCHEMBL23039533 0.81 AHR (0.60) CDK4CCND1GABRPGABRDGABRA1
Biphenyl SCHEMBL28904227 0.79 RXFP1 (0.58) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL23039563 0.79 AHR (0.53) CDK4CCND1GABRPGABRDGABRA1
SCHEMBL29888691 0.79 CDK4 (0.55) CDK4CCND1GABRPGABRDGABRA1

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-117460728-A Novel compound and organic light emitting device comprising the same 株式会社LG化学 2024-01-26 — — CN disclosed
US-20230200233-A1 COMPOSITION, ELECTRONIC COMPOMENT AND ELECTRONIC DEVICE CONTAINING THE COMPOSITION SHAANXI LIGHTE OPTOELECTRONICS MATERIAL CO., LTD. (CN) 2023-06-22 — — US disclosed
US-20230200233-A1 COMPOSITION, ELECTRONIC COMPOMENT AND ELECTRONIC DEVICE CONTAINING THE COMPOSITION SHAANXI LIGHTE OPTOELECTRONICS MATERIAL CO., LTD. (CN) 2023-06-22 — — US disclosed
WO-2022260443-A1 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME 주식회사 엘지화학 2022-12-15 — — WO disclosed
WO-2022260443-A1 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME 주식회사 엘지화학 2022-12-15 — — WO disclosed
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