SCHEMBL25964984

SCHEMBL25964984

c1ccc(-c2nc(-c3ccc(-n4c5ccccc5c5cc6c7ccccc7n(-c7ccccc7)c6cc54)cc3)nc(-c3ccc4c(c3)oc3cccc(-c5ccccc5)c34)n2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.37
ATM Q13315 2/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
BACE1 P56817 1/20 0.33
PTGER4 P35408 2/20 0.31
RXFP1 Q9HBX9 1/20 0.31
SMN1; SMN2 Q16637 2/20 0.30
ALDH1A1 P00352 2/20 0.30
TSHR P16473 2/20 0.30
HSD17B10 Q99714 2/20 0.30
HCRTR1 O43613 1/20 0.30
LMNA P02545 1/20 0.30
MEN1 O00255 1/20 0.30
POLB P06746 1/20 0.30
BRCA1 P38398 1/20 0.30
KMT2A Q03164 1/20 0.30
TP53 P04637 1/20 0.30
MAPT P10636 1/20 0.30
HPGD P15428 1/20 0.30
NFKB1 P19838 1/20 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
SCHEMBL25965310 0.97 KDM4E (0.35) KDM4EATML3MBTL1BACE1
SCHEMBL25964983 0.97 KDM4E (0.36) KDM4EATML3MBTL1BACE1PTGER4
SCHEMBL25965027 0.97 KDM4E (0.38) KDM4EATML3MBTL1BACE1PTGER4
SCHEMBL25964990 0.96 KDM4E (0.35) KDM4EATML3MBTL1BACE1
SCHEMBL23299592 0.95 KDM4E (0.38) KDM4EATML3MBTL1BACE1PTGER4
SCHEMBL25964902 0.94 KDM4E (0.35) KDM4EATML3MBTL1BACE1PTGER4
SCHEMBL25965354 0.94 KDM4E (0.35) KDM4EATML3MBTL1BACE1
SCHEMBL25965025 0.94 KDM4E (0.37) KDM4EATML3MBTL1BACE1PTGER4
SCHEMBL25965308 0.93 KDM4E (0.35) KDM4EATML3MBTL1BACE1TP53
SCHEMBL25964903 0.93 KDM4E (0.35) KDM4EATML3MBTL1BACE1PTGER4

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