SCHEMBL29407293

SCHEMBL29407293

Nc1cccc(-c2cccc3ccccc23)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.54
MAPT P10636 3/20 0.50
BRD4 O60885 1/20 0.50
MAP4K4 O95819 1/20 0.50
CA12 O43570 2/20 0.49
CA1 P00915 2/20 0.49
CA2 P00918 2/20 0.49
CA9 Q16790 2/20 0.49
ALDH1A1 P00352 3/20 0.47
HPGD P15428 3/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
HSD17B10 Q99714 2/20 0.47
CDK4 P11802 2/20 0.47
CCND1 P24385 2/20 0.47
MCL1 Q07820 1/20 0.46
ACMSD Q8TDX5 1/20 0.46
AURKA O14965 1/20 0.46
KDM4E B2RXH2 1/20 0.46
LMNA P02545 1/20 0.46

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
SCHEMBL6360162 1.00 MAOA (0.54) MAOAMAPTBRD4MAP4K4CA12
SCHEMBL18326991 0.96 MAOA (0.55) MAOAMAPTBRD4MAP4K4CA12
SCHEMBL22325657 0.91 CA12 (0.60) MAOAMAPTBRD4MAP4K4CA12
SCHEMBL25088311 0.91 HPRT1 (0.52) MAOAMAPTBRD4MAP4K4CA12
SCHEMBL29644565 0.86 CA12 (0.47) MAOAMAPTCA12CA1CA2
SCHEMBL17689707 0.86 CA12 (0.47) MAOAMAPTCA12CA1CA2
SCHEMBL14036308 0.85 MCL1 (0.53) MAPTCA12CA1CA2CA9
SCHEMBL29628903 0.85 MCL1 (0.53) MAPTCA12CA1CA2CA9
SCHEMBL28943142 0.85 MAOA (0.50) MAOAMAPTBRD4MAP4K4ALDH1A1
SCHEMBL19752161 0.83 CA12 (0.49) MAOAMAPTCA12CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107667098-B Compound for organic electric element, organic electric element using same, and electronic device using same 德山新勒克斯有限公司 2024-04-16 CN disclosed
CN-117480152-A Compound, material for organic electroluminescent element, and electronic device 出光兴产株式会社 2024-01-30 CN disclosed
CN-117157276-A Compound, material for organic electroluminescent element, and electronic device 出光兴产株式会社 2023-12-01 CN disclosed
CN-116889122-A Compound, material for organic electroluminescent element, and electronic device 出光兴产株式会社 2023-10-13 CN disclosed
CN-116583161-A Light emitting device and electronic apparatus including the same 三星显示有限公司 2023-08-11 CN disclosed
CN-114728924-A Compound, material for organic electroluminescent element, and electronic device 出光兴产株式会社 2022-07-08 CN disclosed
CN-114206826-A Compound, material for organic electroluminescent element, and electronic device 出光兴产株式会社 2022-03-18 CN disclosed