SCHEMBL25965461

SCHEMBL25965461

c1ccc(-c2ccc(-c3nc(-c4ccc(-n5c6ccccc6c6cc7c(cc65)c5ccccc5n7-c5ccccc5)cc4)nc(-c4ccc5c(c4)oc4ccccc45)n3)cc2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.42
ATM Q13315 2/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
PTGER4 P35408 2/20 0.35
MMP12 P39900 1/20 0.35
MMP13 P45452 1/20 0.35
AHR P35869 2/20 0.35
HDAC4 P56524 1/20 0.34
KMT2A Q03164 2/20 0.34
MEN1 O00255 1/20 0.34
ALDH1A1 P00352 1/20 0.34
MAPT P10636 1/20 0.34
HPGD P15428 1/20 0.34
HCRTR1 O43613 1/20 0.33
LMNA P02545 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
TSHR P16473 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
PTPN1 P18031 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
SCHEMBL25964766 0.99 KDM4E (0.43) KDM4EATML3MBTL1PTGER4MMP12
SCHEMBL27443908 0.97 KDM4E (0.38) KDM4EATML3MBTL1PTGER4MMP12
SCHEMBL25965429 0.97 KDM4E (0.41) KDM4EATML3MBTL1PTGER4MMP12
SCHEMBL27443945 0.97 KDM4E (0.41) KDM4EATML3MBTL1PTGER4MMP12
SCHEMBL23602221 0.95 KDM4E (0.40) KDM4EATML3MBTL1PTGER4MMP12
SCHEMBL25965458 0.95 KDM4E (0.40) KDM4EATML3MBTL1PTGER4MMP12
SCHEMBL22049450 0.95 KDM4E (0.37) KDM4EATML3MBTL1PTGER4MMP12
SCHEMBL27443918 0.95 KDM4E (0.42) KDM4EATML3MBTL1PTGER4MMP12
SCHEMBL25964728 0.95 KDM4E (0.42) KDM4EATML3MBTL1PTGER4MMP12
SCHEMBL16811456 0.95 KDM4E (0.44) KDM4EATML3MBTL1PTGER4MMP12

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