SCHEMBL26007467

SCHEMBL26007467

c1ccc(-c2nc(-c3ccc(-n4c5ccccc5c5ccc6ccccc6c54)cc3)nc(-c3ccc4ccc5c6ccccc6ccc5c4c3)n2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.37
▸ ATM Q13315 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ PDPK1 O15530 8/20 0.36
▸ MAPT P10636 2/20 0.36
▸ NPC1 O15118 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ RECQL P46063 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ HPRT1 P00492 1/20 0.34
▸ CYP1A2 P05177 2/20 0.34
▸ CYP1B1 Q16678 2/20 0.34
▸ CYP1A1 P04798 1/20 0.34
▸ CA9 Q16790 1/20 0.33
▸ RXRA P19793 1/20 0.33
▸ ALDH1A1 P00352 2/20 0.33
▸ CYP2C9 P11712 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ MEN1 O00255 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
SCHEMBL26007550 0.95 PDPK1 (0.41) KDM4EATML3MBTL1PDPK1MAPT
SCHEMBL17943377 0.95 ATM (0.37) KDM4EATML3MBTL1PDPK1MAPT
SCHEMBL26007468 0.93 KDM4E (0.36) KDM4EATML3MBTL1PDPK1MAPT
SCHEMBL23759546 0.92 ATM (0.45) KDM4EATML3MBTL1PDPK1MAPT
SCHEMBL13086799 0.92 L3MBTL1 (0.43) KDM4EATML3MBTL1PDPK1MAPT
SCHEMBL26059627 0.92 ATM (0.36) KDM4EATML3MBTL1PDPK1MAPT
SCHEMBL26012337 0.92 KDM4E (0.36) KDM4EATML3MBTL1PDPK1MAPT
SCHEMBL26055006 0.92 ATM (0.36) KDM4EATML3MBTL1PDPK1MAPT
SCHEMBL17943405 0.91 L3MBTL1 (0.42) KDM4EATML3MBTL1PDPK1MAPT
SCHEMBL17943425 0.91 L3MBTL1 (0.42) KDM4EATML3MBTL1PDPK1MAPT

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023146296-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2023-08-03 — — WO disclosed
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