SCHEMBL25919675

SCHEMBL25919675

Cc1ccc(-c2ccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5cccc(-c6ccc(C)cc6)c5)ccc43)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.47
ATM Q13315 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
AKR1C4 P17516 1/20 0.41
AKR1C3 P42330 1/20 0.41
AKR1C2 P52895 1/20 0.41
AKR1C1 Q04828 1/20 0.41
TSPO P30536 1/20 0.40
ALDH1A1 P00352 3/20 0.39
LMNA P02545 2/20 0.39
GAA P10253 1/20 0.39
GRM5 P41594 1/20 0.38
MAPT P10636 2/20 0.38
HTT P42858 2/20 0.38
PTGER4 P35408 1/20 0.38
HDAC4 P56524 1/20 0.37
RXFP1 Q9HBX9 2/20 0.37
TP53 P04637 1/20 0.36
HPGD P15428 1/20 0.36
PPARG P37231 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
SCHEMBL17178939 0.99 KDM4E (0.50) KDM4EATML3MBTL1AKR1C4AKR1C3
SCHEMBL25672014 0.99 KDM4E (0.50) KDM4EATML3MBTL1AKR1C4AKR1C3
SCHEMBL17178938 0.97 L3MBTL1 (0.51) KDM4EATML3MBTL1AKR1C4AKR1C3
SCHEMBL18779604 0.97 ATM (0.46) KDM4EATML3MBTL1AKR1C4AKR1C3
SCHEMBL26214667 0.96 ATM (0.44) KDM4EATML3MBTL1AKR1C4AKR1C3
SCHEMBL16864258 0.96 ATM (0.49) KDM4EATML3MBTL1AKR1C4AKR1C3
SCHEMBL17178949 0.96 ATM (0.49) KDM4EATML3MBTL1AKR1C4AKR1C3
SCHEMBL25920146 0.94 L3MBTL1 (0.49) KDM4EATML3MBTL1AKR1C4AKR1C3
SCHEMBL25920144 0.94 L3MBTL1 (0.49) KDM4EATML3MBTL1AKR1C4AKR1C3
SCHEMBL17178667 0.94 KDM4E (0.51) KDM4EATML3MBTL1AKR1C4AKR1C3

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 2 patents. 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
WO-2023142486-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