SCHEMBL25966229

SCHEMBL25966229

c1ccc(-c2cccc(-n3c4ccccc4c4ccc5c6ccccc6n(-c6cc(-n7c8ccccc8c8ccccc87)nc(-c7ccccc7)n6)c5c43)c2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.38
ATM Q13315 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
HTT P42858 2/20 0.38
MEN1 O00255 1/20 0.36
GAA P10253 1/20 0.36
KMT2A Q03164 1/20 0.36
MAPT P10636 2/20 0.35
TSHR P16473 2/20 0.35
MAPK1 P28482 2/20 0.35
HSD17B10 Q99714 2/20 0.35
LMNA P02545 1/20 0.35
PDE10A Q9Y233 1/20 0.35
HTR1A P08908 1/20 0.34
HTR7 P34969 1/20 0.34
ABCG2 Q9UNQ0 4/20 0.33
NPSR1 Q6W5P4 1/20 0.33
FAAH O00519 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HSP90AA1 P07900 1/20 0.33

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
SCHEMBL24164187 0.96 KDM4E (0.37) KDM4EATML3MBTL1HTTMEN1
SCHEMBL17809171 0.93 MAPT (0.42) KDM4EATML3MBTL1HTTMEN1
SCHEMBL24164199 0.93 L3MBTL1 (0.41) KDM4EATML3MBTL1HTTMEN1
SCHEMBL24164193 0.92 KDM4E (0.44) KDM4EATML3MBTL1HTTMEN1
SCHEMBL25966200 0.92 KDM4E (0.46) KDM4EATML3MBTL1HTTMEN1
SCHEMBL17809189 0.92 MAPT (0.41) KDM4EATML3MBTL1HTTMEN1
SCHEMBL17809176 0.92 MAPT (0.41) KDM4EATML3MBTL1HTTMEN1
SCHEMBL21017909 0.91 KDM4E (0.45) KDM4EATML3MBTL1HTTMEN1
SCHEMBL10205991 0.91 KDM4E (0.47) KDM4EATML3MBTL1HTTMEN1
SCHEMBL17809175 0.90 ATM (0.42) KDM4EATML3MBTL1HTTMEN1

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