SCHEMBL25965373

SCHEMBL25965373

c1ccc(-c2cccc(-c3nc(-c4cccc(-n5c6ccccc6c6cc7c8ccccc8n(-c8ccccc8)c7cc65)c4)nc(-c4ccc5c(c4)oc4ccccc45)n3)c2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 2/20 0.38
KDM4E B2RXH2 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
MMP12 P39900 1/20 0.35
MMP13 P45452 1/20 0.35
PLA2G2A P14555 3/20 0.34
PLA2G4A P47712 3/20 0.34
HCRTR1 O43613 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
PLA2G10 O15496 1/20 0.33
AHR P35869 1/20 0.32
HPSE Q9Y251 1/20 0.32
PTGER4 P35408 2/20 0.32
MEN1 O00255 1/20 0.32
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
HPGD P15428 1/20 0.32
KMT2A Q03164 1/20 0.32
PDE10A Q9Y233 1/20 0.31

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
SCHEMBL25965425 0.97 KDM4E (0.39) ATMKDM4EL3MBTL1MMP12MMP13
SCHEMBL25965389 0.97 ATM (0.39) ATMKDM4EL3MBTL1MMP12MMP13
SCHEMBL25965255 0.97 KDM4E (0.39) ATMKDM4EL3MBTL1MMP12MMP13
SCHEMBL24216733 0.96 KDM4E (0.40) ATMKDM4EL3MBTL1MMP12MMP13
SCHEMBL25965087 0.96 KDM4E (0.40) ATMKDM4EL3MBTL1MMP12MMP13
SCHEMBL23318267 0.95 ATM (0.38) ATMKDM4EL3MBTL1MMP12MMP13
SCHEMBL19769739 0.95 ATM (0.38) ATMKDM4EL3MBTL1MMP12MMP13
SCHEMBL23318268 0.95 ATM (0.39) ATMKDM4EL3MBTL1MMP12MMP13
SCHEMBL27441947 0.95 ATM (0.39) ATMKDM4EL3MBTL1MMP12MMP13
SCHEMBL27332477 0.95 ATM (0.38) ATMKDM4EL3MBTL1MMP12MMP13

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