SCHEMBL25920146

SCHEMBL25920146

Cc1ccc2c(c1)c1cc(C)ccc1n2-c1cccc(-c2ccc3c(c2)c2ccccc2n3-c2cccc(-c3ccc4c(c3)c3ccccc3n4-c3ccc(-c4ccccc4)cc3)c2)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.49
KDM4E B2RXH2 1/20 0.49
ATM Q13315 1/20 0.49
TSPO P30536 2/20 0.41
AKR1C4 P17516 1/20 0.39
AKR1C3 P42330 1/20 0.39
AKR1C2 P52895 1/20 0.39
AKR1C1 Q04828 1/20 0.39
RXFP1 Q9HBX9 2/20 0.39
PTGER4 P35408 1/20 0.39
HDAC4 P56524 1/20 0.38
ALDH1A1 P00352 3/20 0.38
GAA P10253 2/20 0.38
LMNA P02545 1/20 0.38
MAPT P10636 2/20 0.37
TP53 P04637 1/20 0.37
AVPR1A P37288 1/20 0.37
BCHE P06276 1/20 0.36
ACHE P22303 1/20 0.36
NPY5R Q15761 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
SCHEMBL25920144 1.00 L3MBTL1 (0.49) L3MBTL1KDM4EATMTSPOAKR1C4
SCHEMBL17178942 0.99 L3MBTL1 (0.50) L3MBTL1KDM4EATMTSPOAKR1C4
SCHEMBL17178940 0.99 L3MBTL1 (0.50) L3MBTL1KDM4EATMTSPOAKR1C4
SCHEMBL25925769 0.97 L3MBTL1 (0.49) L3MBTL1KDM4EATMTSPOAKR1C4
SCHEMBL17178947 0.97 ATM (0.47) L3MBTL1KDM4EATMTSPOAKR1C4
SCHEMBL17178619 0.96 L3MBTL1 (0.50) L3MBTL1KDM4EATMTSPOAKR1C4
SCHEMBL26717825 0.96 L3MBTL1 (0.50) L3MBTL1KDM4EATMTSPOAKR1C4
SCHEMBL17178939 0.96 KDM4E (0.50) L3MBTL1KDM4EATMTSPOAKR1C4
SCHEMBL18779591 0.96 L3MBTL1 (0.50) L3MBTL1KDM4EATMTSPOAKR1C4
SCHEMBL25672014 0.96 KDM4E (0.50) L3MBTL1KDM4EATMTSPOAKR1C4

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