SCHEMBL25965007

SCHEMBL25965007

c1ccc(-c2nc(-c3ccc(-n4c5ccccc5c5c6c7ccccc7n(-c7ccccc7)c6ccc54)cc3)nc(-c3ccc4c(c3)oc3cccc(-c5ccccc5)c34)n2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.35
L3MBTL1 Q9Y468 3/20 0.35
ATM Q13315 2/20 0.35
BACE1 P56817 1/20 0.33
RXFP1 Q9HBX9 1/20 0.31
PTGER4 P35408 1/20 0.31
ALDH1A1 P00352 3/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
TSHR P16473 2/20 0.31
HSD17B10 Q99714 2/20 0.31
HCRTR1 O43613 1/20 0.31
LMNA P02545 1/20 0.31
MEN1 O00255 1/20 0.31
POLB P06746 1/20 0.31
BRCA1 P38398 1/20 0.31
KMT2A Q03164 1/20 0.31
TP53 P04637 2/20 0.30
MAPT P10636 2/20 0.30
HPGD P15428 2/20 0.30
MAPK1 P28482 2/20 0.30

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
SCHEMBL25965004 0.97 KDM4E (0.34) KDM4EL3MBTL1ATMBACE1RXFP1
SCHEMBL24078212 0.96 KDM4E (0.35) KDM4EL3MBTL1ATMBACE1
SCHEMBL24078753 0.96 KDM4E (0.33) KDM4EL3MBTL1ATMBACE1RXFP1
SCHEMBL23339337 0.96 BACE1 (0.34) KDM4EL3MBTL1ATMBACE1PTGER4
SCHEMBL23299592 0.94 KDM4E (0.38) KDM4EL3MBTL1ATMBACE1RXFP1
SCHEMBL25965034 0.93 KDM4E (0.34) KDM4EL3MBTL1ATMBACE1
SCHEMBL25965018 0.93 KDM4E (0.34) KDM4EL3MBTL1ATMBACE1
SCHEMBL23339339 0.93 BACE1 (0.33) KDM4EL3MBTL1ATMBACE1HCRTR1
SCHEMBL21583540 0.93 BACE1 (0.33) KDM4EL3MBTL1ATMBACE1ALDH1A1
SCHEMBL22257939 0.93 KDM4E (0.37) KDM4EL3MBTL1ATMRXFP1ALDH1A1

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
US-20230255106-A1 ORGANIC ELECTROLUMINESCENT APPARATUS MERCK PATENT GMBH (DE) 2023-08-10 US disclosed
US-20230255106-A1 ORGANIC ELECTROLUMINESCENT APPARATUS MERCK PATENT GMBH (DE) 2023-08-10 US disclosed