SCHEMBL22901119

SCHEMBL22901119

c1ccc(-c2cccc(-n3c4ccccc4c4ccc(-c5nc(-c6ccccc6)nc(-c6cccc7ccccc67)n5)cc43)c2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.39
▸ ATM Q13315 2/20 0.39
▸ L3MBTL1 Q9Y468 2/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ TP53 P04637 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ TSHR P16473 1/20 0.39
▸ NFKB1 P19838 1/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ NFKB2 Q00653 1/20 0.39
▸ RELA Q04206 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ PDE10A Q9Y233 1/20 0.38
▸ CA12 O43570 1/20 0.36
▸ CA1 P00915 1/20 0.36
▸ CA2 P00918 1/20 0.36
▸ CA9 Q16790 1/20 0.36

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
SCHEMBL26451234 0.95 KDM4E (0.37) KDM4EATML3MBTL1ALDH1A1TP53
SCHEMBL20291258 0.94 KDM4E (0.40) KDM4EATML3MBTL1ALDH1A1TP53
SCHEMBL6375175 0.93 KDM4E (0.40) KDM4EATML3MBTL1ALDH1A1TP53
SCHEMBL20291236 0.93 KDM4E (0.39) KDM4EATML3MBTL1ALDH1A1TP53
SCHEMBL25668641 0.93 KDM4E (0.44) KDM4EATML3MBTL1ALDH1A1TP53
SCHEMBL24104203 0.93 KDM4E (0.45) KDM4EATML3MBTL1ALDH1A1TP53
SCHEMBL24361964 0.92 KDM4E (0.36) KDM4EATML3MBTL1ALDH1A1TP53
SCHEMBL14748983 0.92 KDM4E (0.41) KDM4EATML3MBTL1ALDH1A1TP53
SCHEMBL22596258 0.92 KDM4E (0.41) KDM4EATML3MBTL1ALDH1A1TP53
SCHEMBL25726593 0.92 KDM4E (0.40) KDM4EATML3MBTL1ALDH1A1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210020849-A1 PLURALITY OF HOST MATERIALS AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME DUPONT SPECIALTY MATERIALS KOREA LTD (KR) 2021-01-21 — — US disclosed
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