SCHEMBL25964649

SCHEMBL25964649

c1ccc(-c2ccc(-n3c4ccccc4c4ccc5c6ccccc6n(-c6cccc(-c7nc(-c8ccccc8)nc(-c8ccc9oc%10ccccc%10c9c8)n7)c6)c5c43)cc2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.35
ATM Q13315 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
CHEK2 O96017 1/20 0.35
PLA2G2A P14555 2/20 0.34
PLA2G4A P47712 2/20 0.34
SIRT2 Q8IXJ6 1/20 0.34
SIRT1 Q96EB6 1/20 0.34
PLA2G10 O15496 1/20 0.33
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
ALDH1A1 P00352 2/20 0.32
MAPT P10636 2/20 0.32
HPGD P15428 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
GAA P10253 1/20 0.32
PTGER4 P35408 2/20 0.32
TSHR P16473 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
SCHEMBL22049926 0.98 KDM4E (0.37) KDM4EATML3MBTL1CHEK2PLA2G2A
SCHEMBL25964618 0.96 KDM4E (0.39) KDM4EATML3MBTL1CHEK2PLA2G2A
SCHEMBL25965435 0.95 KDM4E (0.36) KDM4EATML3MBTL1MEN1KMT2A
SCHEMBL22049427 0.95 KDM4E (0.36) KDM4EATML3MBTL1MEN1KMT2A
SCHEMBL26473000 0.95 PLA2G2A (0.34) KDM4EATML3MBTL1CHEK2PLA2G2A
SCHEMBL24163788 0.94 PLA2G2A (0.35) KDM4EATML3MBTL1CHEK2PLA2G2A
SCHEMBL22352673 0.94 KDM4E (0.35) KDM4EATML3MBTL1CHEK2PLA2G2A
SCHEMBL21365924 0.94 KDM4E (0.37) KDM4EATML3MBTL1CHEK2PLA2G2A
SCHEMBL25965397 0.94 KDM4E (0.37) KDM4EATML3MBTL1MEN1KMT2A
SCHEMBL21365903 0.93 KDM4E (0.36) KDM4EATML3MBTL1CHEK2PLA2G2A

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