SCHEMBL21868079

SCHEMBL21868079

CC1(C)c2ccccc2C2(c3ccccc3-c3ccccc32)c2cccc(-c3nc(-c4ccccc4)c4ccccc4n3)c21

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
ATM Q13315 1/20 0.44
NUDT1 P36639 3/20 0.43
MAPT P10636 4/20 0.40
GAA P10253 2/20 0.40
ADORA2A P29274 4/20 0.39
ALDH1A1 P00352 5/20 0.38
KDM4E B2RXH2 4/20 0.38
HPGD P15428 2/20 0.36
NPSR1 Q6W5P4 1/20 0.36
WHR1 P49842 1/20 0.36
GLA P06280 1/20 0.36
LMNA P02545 2/20 0.36
MAPK1 P28482 1/20 0.36
RAD52 P43351 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
HTT P42858 1/20 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
SCHEMBL20086910 0.91 MEN1 (0.47) MEN1KMT2AATMNUDT1MAPT
SCHEMBL24648103 0.91 MEN1 (0.43) MEN1KMT2AATMNUDT1MAPT
SCHEMBL21868070 0.90 MEN1 (0.44) MEN1KMT2AATMNUDT1MAPT
SCHEMBL24293722 0.90 KMT2A (0.40) MEN1KMT2AATMNUDT1MAPT
SCHEMBL24648211 0.89 ALDH1A1 (0.37) MEN1KMT2AATMMAPTADORA2A
SCHEMBL18374498 0.89 MEN1 (0.48) MEN1KMT2AATMNUDT1MAPT
SCHEMBL21868326 0.86 MEN1 (0.43) MEN1KMT2AATMNUDT1MAPT
SCHEMBL18456033 0.85 MEN1 (0.49) MEN1KMT2AATMNUDT1MAPT
SCHEMBL21868335 0.84 MEN1 (0.44) MEN1KMT2AATMNUDT1MAPT
SCHEMBL19760007 0.84 MEN1 (0.43) MEN1KMT2AATMNUDT1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230024114-A1 ORGANIC LIGHT-EMITTING DEVICE LG CHEM, LTD. (KR) 2023-01-26 US disclosed
US-20220376178-A1 ORGANIC LIGHT-EMITTING DEVICE LG CHEM, LTD. (KR) 2022-11-24 US disclosed
US-20220123218-A1 ORGANIC ELECTROLUMINESCENT DEVICE LG CHEM, LTD. (KR) 2022-04-21 US disclosed
WO-2020067823-A1 ORGANIC ELECTROLUMINESCENT ELEMENT 주식회사 엘지화학 2020-04-02 WO disclosed