SCHEMBL21636032

SCHEMBL21636032

O=c1c2ccccc2c2cc(-c3cccc(-c4cccc(-c5ccc6c7ccccc7c7ccccc7c6c5)c4)c3)cc3c4cc(-c5cccc(-c6ccccc6)c5)ccc4n1c23

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.40
BRD4 O60885 5/20 0.39
KDM4E B2RXH2 1/20 0.37
MEN1 O00255 1/20 0.37
ALDH1A1 P00352 1/20 0.37
POLB P06746 1/20 0.37
MAPT P10636 1/20 0.37
HPGD P15428 1/20 0.37
HTT P42858 1/20 0.37
KMT2A Q03164 1/20 0.37
TSPO P30536 1/20 0.36
FEN1 P39748 1/20 0.36
NR4A2 P43354 2/20 0.36
PLA2G2A P14555 3/20 0.35
PLA2G4A P47712 3/20 0.35
PLA2G10 O15496 1/20 0.35
PRKDC P78527 1/20 0.33
MAPK1 P28482 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2C9 P11712 1/20 0.33

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
SCHEMBL21142693 1.00 MAOB (0.40) MAOBBRD4KDM4EMEN1ALDH1A1
SCHEMBL21636126 1.00 MAOB (0.40) MAOBBRD4KDM4EMEN1ALDH1A1
SCHEMBL26042857 1.00 MAOB (0.40) MAOBBRD4KDM4EMEN1ALDH1A1
SCHEMBL22022438 1.00 MAOB (0.40) MAOBBRD4KDM4EMEN1ALDH1A1
SCHEMBL20632499 0.97 MAOB (0.39) MAOBBRD4KDM4EMEN1ALDH1A1
SCHEMBL14732295 0.97 MAOB (0.39) MAOBBRD4KDM4EMEN1ALDH1A1
SCHEMBL21636127 0.97 KDM4E (0.38) MAOBBRD4KDM4EMEN1ALDH1A1
SCHEMBL21636051 0.97 MAOB (0.42) MAOBBRD4KDM4EMEN1ALDH1A1
SCHEMBL15213890 0.97 MAOB (0.39) MAOBBRD4KDM4EMEN1ALDH1A1
SCHEMBL15213961 0.97 MAOB (0.42) MAOBBRD4KDM4EMEN1ALDH1A1

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
US-11778907-B2 Composition for organic electronic devices MERCK PATENT GMBH (DE) 2023-10-03 US disclosed
US-11778907-B2 Composition for organic electronic devices MERCK PATENT GMBH (DE) 2023-10-03 US disclosed
EP-3823958-B1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2023-08-23 EP disclosed
US-20200168810-A1 COMPOSITION FOR ORGANIC ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2020-05-28 US disclosed
WO-2020016264-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2020-01-23 WO disclosed