SCHEMBL24152883

SCHEMBL24152883

c1ccc(-c2nc(-c3ccc(-c4ccc(-n5c6ccccc6c6cc7ccccc7cc65)cc4)cc3)nc(-c3cc4ccccc4c4ccccc34)n2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ATM Q13315 2/20 0.40
▸ KDM4E B2RXH2 2/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ CYP11B1 P15538 1/20 0.35
▸ HDAC4 P56524 1/20 0.35
▸ AKR1C4 P17516 1/20 0.33
▸ AKR1C3 P42330 1/20 0.33
▸ AKR1C2 P52895 1/20 0.33
▸ AKR1C1 Q04828 1/20 0.33
▸ RXRA P19793 1/20 0.32
▸ HTR6 P50406 2/20 0.32
▸ ALOX5 P09917 1/20 0.32
▸ KMT2A Q03164 3/20 0.32
▸ MEN1 O00255 2/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ PTGER4 P35408 1/20 0.32
▸ RAC2 P15153 1/20 0.32
▸ RAC3 P60763 1/20 0.32

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
SCHEMBL17943741 0.98 KDM4E (0.38) ATMKDM4EL3MBTL1CYP11B1HDAC4
SCHEMBL17943393 0.94 ATM (0.45) ATMKDM4EL3MBTL1CYP11B1HDAC4
SCHEMBL21191468 0.93 ATM (0.46) ATMKDM4EL3MBTL1CYP11B1HDAC4
SCHEMBL21191476 0.92 KDM4E (0.44) ATMKDM4EL3MBTL1CYP11B1HDAC4
SCHEMBL17943443 0.91 ATM (0.47) ATMKDM4EL3MBTL1HDAC4RXRA
SCHEMBL17943458 0.91 ATM (0.47) ATMKDM4EL3MBTL1HDAC4RXRA
SCHEMBL24152076 0.91 ATM (0.47) ATMKDM4EL3MBTL1HDAC4RXRA
SCHEMBL17943447 0.91 KDM4E (0.43) ATMKDM4EL3MBTL1CYP11B1HDAC4
SCHEMBL17943394 0.91 ATM (0.47) ATMKDM4EL3MBTL1HDAC4RXRA
SCHEMBL26007548 0.91 KDM4E (0.38) ATMKDM4EL3MBTL1HDAC4RXRA

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
WO-2021261977-A1 ORGANIC LIGHT-EMITTING DEVICE 주식회사 엘지화학 2021-12-30 — — WO disclosed
WO-2021261962-A1 ORGANIC LIGHT-EMITTING DEVICE 주식회사 엘지화학 2021-12-30 — — WO disclosed
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