SCHEMBL25919261

SCHEMBL25919261

c1ccc(-c2ccc(-n3c4ccccc4c4cc(-c5ccccc5-n5c6ccccc6c6cc(-c7ccccc7-n7c8ccccc8c8ccccc87)ccc65)ccc43)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.50
KDM4E B2RXH2 1/20 0.50
ATM Q13315 1/20 0.50
HDAC4 P56524 1/20 0.41
ALDH1A1 P00352 2/20 0.41
TSPO P30536 2/20 0.39
EDNRA P25101 2/20 0.36
EDNRB P24530 1/20 0.36
KMT2A Q03164 2/20 0.36
IL1R1 P14778 1/20 0.36
PDE6D O43924 1/20 0.35
MEN1 O00255 1/20 0.35
MAPT P10636 1/20 0.35
HTT P42858 1/20 0.35
RAC2 P15153 1/20 0.34
RAC3 P60763 1/20 0.34
CDC42 P60953 1/20 0.34
RAC1 P63000 1/20 0.34
PTGER4 P35408 1/20 0.34
PTPN1 P18031 2/20 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
SCHEMBL25918822 1.00 L3MBTL1 (0.50) L3MBTL1KDM4EATMHDAC4ALDH1A1
SCHEMBL25919267 0.98 L3MBTL1 (0.49) L3MBTL1KDM4EATMHDAC4ALDH1A1
SCHEMBL25925301 0.98 L3MBTL1 (0.49) L3MBTL1KDM4EATMHDAC4ALDH1A1
SCHEMBL25936867 0.98 L3MBTL1 (0.49) L3MBTL1KDM4EATMHDAC4ALDH1A1
SCHEMBL23118924 0.96 L3MBTL1 (0.46) L3MBTL1KDM4EATMHDAC4ALDH1A1
SCHEMBL22172799 0.96 L3MBTL1 (0.46) L3MBTL1KDM4EATMHDAC4ALDH1A1
SCHEMBL22173043 0.96 L3MBTL1 (0.46) L3MBTL1KDM4EATMHDAC4ALDH1A1
SCHEMBL22173039 0.96 L3MBTL1 (0.46) L3MBTL1KDM4EATMHDAC4ALDH1A1
SCHEMBL26481065 0.95 L3MBTL1 (0.53) L3MBTL1KDM4EATMHDAC4ALDH1A1
SCHEMBL25918821 0.95 L3MBTL1 (0.53) L3MBTL1KDM4EATMHDAC4ALDH1A1

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
WO-2023142485-A1 BORON-NITROGEN COMPOUND, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF 季华恒烨(佛山)电子材料有限公司 2023-08-03 WO disclosed