SCHEMBL25965255

SCHEMBL25965255

c1ccc(-c2cccc(-c3ccc4c(c3)oc3cc(-c5nc(-c6ccccc6)nc(-c6cccc(-n7c8ccccc8c8cc9c%10ccccc%10n(-c%10ccccc%10)c9cc87)c6)n5)ccc34)c2)cc1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.39
ATM Q13315 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
HPSE Q9Y251 2/20 0.32
PTGER4 P35408 1/20 0.32
PDE10A Q9Y233 1/20 0.32
MMP12 P39900 1/20 0.31
MMP13 P45452 1/20 0.31
PRKDC P78527 1/20 0.31
AVPR1A P37288 1/20 0.31
HDAC4 P56524 1/20 0.31
KMT2A Q03164 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
SCHEMBL25965087 0.99 KDM4E (0.40) KDM4EATML3MBTL1HPSEPTGER4
SCHEMBL22240712 0.98 L3MBTL1 (0.41) KDM4EATML3MBTL1PTGER4PDE10A
SCHEMBL25965373 0.97 ATM (0.38) KDM4EATML3MBTL1HPSEPTGER4
SCHEMBL25965270 0.97 KDM4E (0.40) KDM4EATML3MBTL1HPSEPTGER4
SCHEMBL27441835 0.96 KDM4E (0.36) KDM4EATML3MBTL1HPSEPDE10A
SCHEMBL27441819 0.96 KDM4E (0.36) KDM4EATML3MBTL1HPSEPDE10A
SCHEMBL27441831 0.96 KDM4E (0.36) KDM4EATML3MBTL1HPSEPDE10A
SCHEMBL25965425 0.96 KDM4E (0.39) KDM4EATML3MBTL1PTGER4MMP12
SCHEMBL27441829 0.96 KDM4E (0.36) KDM4EATML3MBTL1HPSEPDE10A
SCHEMBL25965099 0.96 KDM4E (0.41) KDM4EATML3MBTL1HPSEPTGER4

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