SCHEMBL22706297

SCHEMBL22706297

c1ccc(-c2c(-c3c4cccc(-c5ccc6c7ccccc7n(-c7ccccc7)c6c5)c4cc4c(-c5ccc6c7ccccc7n(-c7ccccc7)c6c5)cccc34)ccc3ccccc23)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.41
KDM4E B2RXH2 1/20 0.41
ATM Q13315 1/20 0.41
KMT2A Q03164 2/20 0.36
NTSR1 P30989 2/20 0.36
SOS1 Q07889 1/20 0.35
MCL1 Q07820 1/20 0.33
ACMSD Q8TDX5 1/20 0.33
ALOX5 P09917 1/20 0.33
MAPK14 Q16539 1/20 0.32
CYP2C9 P11712 2/20 0.32
CYP2C19 P33261 2/20 0.32
HSD17B1 P14061 2/20 0.32
HSD17B2 P37059 2/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2B6 P20813 1/20 0.32
IL1R1 P14778 1/20 0.32
MAPT P10636 2/20 0.31

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
SCHEMBL22705903 0.93 L3MBTL1 (0.41) L3MBTL1KDM4EATMKMT2ANTSR1
SCHEMBL22707780 0.91 L3MBTL1 (0.41) L3MBTL1KDM4EATMKMT2ANTSR1
SCHEMBL22706374 0.89 KDM4E (0.46) L3MBTL1KDM4EATMKMT2ANTSR1
SCHEMBL22708162 0.89 L3MBTL1 (0.41) L3MBTL1KDM4EATMKMT2ANTSR1
SCHEMBL22706683 0.88 L3MBTL1 (0.47) L3MBTL1KDM4EATMKMT2ANTSR1
SCHEMBL22706415 0.88 L3MBTL1 (0.50) L3MBTL1KDM4EATMKMT2AMCL1
SCHEMBL22705747 0.87 L3MBTL1 (0.42) L3MBTL1KDM4EATMKMT2ANTSR1
SCHEMBL22705794 0.87 L3MBTL1 (0.46) L3MBTL1KDM4EATMKMT2ANTSR1
SCHEMBL22706241 0.87 L3MBTL1 (0.49) L3MBTL1KDM4EATMKMT2AMCL1
SCHEMBL22706345 0.87 L3MBTL1 (0.49) L3MBTL1KDM4EATMKMT2AMAPK14

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-20200373496-A1 ORGANIC LIGHT EMITTING ELEMENT LG CHEM, LTD. (KR) 2020-11-26 US disclosed