SCHEMBL21578624

SCHEMBL21578624

c1ccc(-c2cc(-c3ccccc3)cc(-n3c4ccccc4c4cccc(-c5cccc6c7ccccc7n(-c7ccc8c9ccccc9c9ccccc9c8c7)c56)c43)c2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DUSP3 P51452 1/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
KDM4E B2RXH2 1/20 0.38
ATM Q13315 1/20 0.38
PDE10A Q9Y233 1/20 0.34
MAPK14 Q16539 1/20 0.34
KMT2A Q03164 3/20 0.33
MEN1 O00255 2/20 0.33
GAA P10253 1/20 0.33
RAC2 P15153 1/20 0.32
RAC3 P60763 1/20 0.32
CDC42 P60953 1/20 0.32
RAC1 P63000 1/20 0.32
OPRD1 P41143 1/20 0.31
HDAC4 P56524 1/20 0.31
IL1R1 P14778 1/20 0.31
PDE6D O43924 1/20 0.30
ALDH1A1 P00352 1/20 0.30
MAPT P10636 1/20 0.30
HTT P42858 1/20 0.30

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
SCHEMBL21588644 0.93 ATM (0.42) DUSP3L3MBTL1KDM4EATMPDE10A
SCHEMBL20988507 0.90 DUSP3 (0.39) DUSP3L3MBTL1KDM4EATMPDE10A
SCHEMBL15502568 0.89 L3MBTL1 (0.50) DUSP3L3MBTL1KDM4EATMPDE10A
SCHEMBL26526080 0.89 DUSP3 (0.45) DUSP3L3MBTL1KDM4EATMMAPK14
SCHEMBL21578501 0.87 L3MBTL1 (0.52) DUSP3L3MBTL1KDM4EATMKMT2A
SCHEMBL14296011 0.87 L3MBTL1 (0.43) DUSP3L3MBTL1KDM4EATMPDE10A
SCHEMBL21578622 0.87 DUSP3 (0.36) DUSP3L3MBTL1KDM4EATMPDE10A
SCHEMBL15502707 0.86 L3MBTL1 (0.47) DUSP3L3MBTL1KDM4EATMPDE10A
SCHEMBL22173204 0.86 L3MBTL1 (0.47) DUSP3L3MBTL1KDM4EATMPDE10A
SCHEMBL21566367 0.86 ATM (0.46) DUSP3L3MBTL1KDM4EATMPDE10A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10978642-B2 Mixture, composition and organic electronic device GUANGZHOU CHINARAY OPTOELECTRONIC MATERIALS LTD. (CN) 2021-04-13 US disclosed
US-20200098992-A1 MIXTURE, COMPOSITION AND ORGANIC ELECTRONIC DEVICE GUANGZHOU CHINARAY OPTOELECTRONIC MATERIALS LTD. (CN) 2020-03-26 US disclosed
US-20190355911-A1 ORGANIC MIXTURE, ORGANIC COMPOSITION, ORGANIC ELECTRONIC COMPONENT AND PREPARATION METHOD THEREFOR GUANGZHOU CHINARAY OPTOELECTRONIC MATERIALS LTD. (CN) 2019-11-21 US disclosed