SCHEMBL29993469

SCHEMBL29993469

c1cncc(-c2cccc(-c3nc(-c4cccc(-c5cccnc5)c4)nc(-c4cccc(-c5cccnc5)c4)n3)c2)c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 5/20 0.62
ALDH1A1 P00352 2/20 0.62
CYP1A2 P05177 1/20 0.62
CYP3A4 P08684 1/20 0.62
MKNK1 Q9BUB5 2/20 0.60
MKNK2 Q9HBH9 2/20 0.60
MEN1 O00255 1/20 0.60
PSIP1 O75475 1/20 0.60
AXL P30530 1/20 0.60
CYP11B1 P15538 6/20 0.58
CYP11B2 P19099 6/20 0.58
CYP19A1 P11511 3/20 0.58
CYP17A1 P05093 3/20 0.58
KMO O15229 1/20 0.58
KDM4E B2RXH2 1/20 0.54
LMNA P02545 1/20 0.54
TP53 P04637 1/20 0.54
MAPT P10636 1/20 0.54
HPGD P15428 1/20 0.54
ALOX15 P16050 1/20 0.54

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
SCHEMBL29353429 1.00 CYP2A6 (0.62) CYP2A6ALDH1A1CYP1A2CYP3A4MKNK1
SCHEMBL16410013 1.00 CYP2A6 (0.62) CYP2A6ALDH1A1CYP1A2CYP3A4MKNK1
SCHEMBL17367790 1.00 CYP2A6 (0.62) CYP2A6ALDH1A1CYP1A2CYP3A4MKNK1
SCHEMBL30435038 1.00 CYP2A6 (0.62) CYP2A6ALDH1A1CYP1A2CYP3A4MKNK1
SCHEMBL17755349 0.94 CYP19A1 (0.58) CYP2A6ALDH1A1CYP1A2CYP3A4MKNK1
SCHEMBL18327328 0.94 CYP19A1 (0.58) CYP2A6ALDH1A1CYP1A2CYP3A4MKNK1
SCHEMBL19238737 0.94 CYP19A1 (0.58) CYP2A6ALDH1A1CYP1A2CYP3A4MKNK1
SCHEMBL26077645 0.94 CYP11B2 (0.58) CYP2A6ALDH1A1CYP1A2CYP3A4MKNK1
SCHEMBL18624813 0.94 CYP19A1 (0.58) CYP2A6ALDH1A1CYP1A2CYP3A4MKNK1
SCHEMBL17720949 0.94 CYP19A1 (0.58) CYP2A6ALDH1A1CYP1A2CYP3A4MKNK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118265322-A Light emitting device 株式会社半导体能源研究所 2024-06-28 CN disclosed
CN-115433486-B Printing ink, light emitting device and display device 广东聚华印刷显示技术有限公司 2023-12-05 CN disclosed
CN-113979885-B Method for synthesizing amide compounds 温州大学 2023-09-22 CN disclosed
CN-112331775-B Quantum dot light-emitting device, preparation method thereof and light-emitting device 广东聚华印刷显示技术有限公司 2023-04-07 CN disclosed
CN-113594381-B Light emitting device, method of manufacturing the same, and light emitting apparatus 广东聚华印刷显示技术有限公司 2023-01-31 CN disclosed
CN-115528185-A Composition for organic light emitting diode and application thereof 广东聚华印刷显示技术有限公司 2022-12-27 CN disclosed
CN-113611805-B Light emitting device, method of manufacturing the same, and light emitting apparatus 广东聚华印刷显示技术有限公司 2022-12-27 CN disclosed
CN-115433486-A Printing ink, light emitting device and display device 广东聚华印刷显示技术有限公司 2022-12-06 CN disclosed