SCHEMBL29354549

SCHEMBL29354549

Brc1cc2cccc3oc4cccc1c4c23

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 5/20 0.40
MAOB P27338 3/20 0.40
GABRP O00591 1/20 0.36
GABRD O14764 1/20 0.36
GABRA1 P14867 1/20 0.36
GABRB1 P18505 1/20 0.36
GABRG2 P18507 1/20 0.36
GABRB3 P28472 1/20 0.36
GABRA5 P31644 1/20 0.36
GABRA3 P34903 1/20 0.36
GABRA2 P47869 1/20 0.36
GABRB2 P47870 1/20 0.36
GABRA4 P48169 1/20 0.36
GABRE P78334 1/20 0.36
GABRA6 Q16445 1/20 0.36
GABRG1 Q8N1C3 1/20 0.36
GABRG3 Q99928 1/20 0.36
GABRQ Q9UN88 1/20 0.36
ALDH1A1 P00352 5/20 0.34
HPGD P15428 4/20 0.34

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
SCHEMBL3469400 0.83 CYP1A2 (0.46) MAOAMAOBALDH1A1HPGDHSD17B10
SCHEMBL15769860 0.81 CYP1A2 (0.45) MAOAALDH1A1HPGDKDM4EHSD17B10
SCHEMBL31266564 0.77 CYP1A2 (0.57) MAOAALDH1A1HPGDKDM4EMAPT
SCHEMBL308801 0.77 CYP1A2 (0.57) MAOAALDH1A1HPGDKDM4EMAPT
SCHEMBL24614966 0.75 CDC14B (0.42) MAOAMAOBALDH1A1HPGDKDM4E
SCHEMBL16294425 0.75 MAOA (0.40) MAOAMAOBGABRPGABRDGABRA1
SCHEMBL18148956 0.74 ALDH1A1 (0.40) MAOAMAOBGABRPGABRDGABRA1
SCHEMBL16799626 0.74 CYP1A2 (0.40) MAOAMAOBGABRPGABRDGABRA1
SCHEMBL2815890 0.73 CYP1A2 (0.53) MAOAALDH1A1HPGDKDM4EHSD17B10
SCHEMBL16307762 0.73 ALOX5 (0.49) MAOAMAOBALDH1A1HPGDKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118561837-A Organic electroluminescent device 罗门哈斯电子材料韩国有限公司 2024-08-30 CN disclosed
CN-113969167-A Multiple kinds of light emitting materials, organic electroluminescent compounds and organic electroluminescent device comprising the same 罗门哈斯电子材料韩国有限公司 2022-01-25 CN disclosed