SCHEMBL22706261

SCHEMBL22706261

c1ccc(-c2c3cccc(-c4ccc(-c5cccc6c5c5ccccc5n6-c5ccccc5)cc4)c3cc3c(-c4ccc(-c5cccc6c5c5ccccc5n6-c5ccccc5)cc4)cccc23)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.45
KDM4E B2RXH2 1/20 0.45
ATM Q13315 1/20 0.45
KMT2A Q03164 3/20 0.42
MAPK14 Q16539 1/20 0.36
IL1R1 P14778 1/20 0.36
MEN1 O00255 2/20 0.35
ALDH1A1 P00352 2/20 0.35
MAPT P10636 1/20 0.35
HTT P42858 1/20 0.35
HDAC4 P56524 1/20 0.33
HSD17B10 Q99714 2/20 0.33
HTR6 P50406 1/20 0.33
RXFP1 Q9HBX9 1/20 0.32
JAK2 O60674 1/20 0.32
JAK3 P52333 1/20 0.32
POLB P06746 1/20 0.32
TSHR P16473 1/20 0.32
BRCA1 P38398 1/20 0.32
PRKDC P78527 1/20 0.32

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
SCHEMBL22707447 0.95 L3MBTL1 (0.45) L3MBTL1KDM4EATMKMT2AMAPK14
SCHEMBL22706344 0.92 L3MBTL1 (0.45) L3MBTL1KDM4EATMKMT2AMAPK14
SCHEMBL20334585 0.92 L3MBTL1 (0.47) L3MBTL1KDM4EATMKMT2AMAPK14
SCHEMBL23702373 0.92 L3MBTL1 (0.46) L3MBTL1KDM4EATMKMT2AMAPK14
SCHEMBL22705849 0.90 L3MBTL1 (0.46) L3MBTL1KDM4EATMKMT2AMAPK14
SCHEMBL22707878 0.90 L3MBTL1 (0.46) L3MBTL1KDM4EATMKMT2AMAPK14
SCHEMBL25126764 0.90 L3MBTL1 (0.46) L3MBTL1KDM4EATMKMT2AMAPK14
SCHEMBL22707136 0.90 L3MBTL1 (0.46) L3MBTL1KDM4EATMKMT2AMAPK14
SCHEMBL22706329 0.90 L3MBTL1 (0.46) L3MBTL1KDM4EATMKMT2AMAPK14
SCHEMBL18672033 0.90 L3MBTL1 (0.46) 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