SCHEMBL22302201

SCHEMBL22302201

c1ccc(-c2ccc(N(c3ccc(-c4cccc5ccccc45)cc3)c3ccc4c5cc6ccccc6cc5n(-c5ccccc5)c4c3)cc2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.38
CA1 P00915 2/20 0.38
CA2 P00918 2/20 0.38
CA9 Q16790 2/20 0.38
MCL1 Q07820 1/20 0.36
ACMSD Q8TDX5 1/20 0.36
KDM4E B2RXH2 1/20 0.36
ATM Q13315 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
PPARG P37231 9/20 0.35
PPARA Q07869 9/20 0.35
CYP2C9 P11712 2/20 0.34
CYP2C19 P33261 2/20 0.34
PPARD Q03181 1/20 0.34
CHRNB4 P30926 1/20 0.33
CHRNA3 P32297 1/20 0.33
CHRNA7 P36544 1/20 0.33
MAPT P10636 1/20 0.33
HDAC8 Q9BY41 1/20 0.33
HDAC6 Q9UBN7 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
SCHEMBL22301520 0.93 KDM4E (0.38) CA12CA1CA2CA9MCL1
SCHEMBL21966004 0.93 CA12 (0.41) CA12CA1CA2CA9MCL1
SCHEMBL16356658 0.93 KDM4E (0.39) CA12CA1CA2CA9MCL1
SCHEMBL24947273 0.93 KDM4E (0.39) CA12CA1CA2CA9MCL1
SCHEMBL21965988 0.92 MCL1 (0.40) CA12CA1CA2CA9MCL1
SCHEMBL21966350 0.92 CA12 (0.39) CA12CA1CA2CA9MCL1
SCHEMBL18371266 0.92 KDM4E (0.45) CA12CA1CA2CA9MCL1
SCHEMBL24947290 0.91 CA12 (0.38) CA12CA1CA2CA9MCL1
SCHEMBL24947281 0.91 CA12 (0.38) CA12CA1CA2CA9MCL1
SCHEMBL18371251 0.91 KDM4E (0.40) CA12CA1CA2CA9MCL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240237518-A1 ORGANIC LIGHT EMITTING DEVICE LG CHEM, LTD. (KR) 2024-07-11 US disclosed
US-20240237518-A1 ORGANIC LIGHT EMITTING DEVICE LG CHEM, LTD. (KR) 2024-07-11 US disclosed
WO-2023090836-A1 ORGANIC LIGHT-EMITTING DEVICE 주식회사 엘지화학 2023-05-25 WO disclosed
US-20220199915-A1 COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING SAME LG CHEM, LTD. (KR) 2022-06-23 US disclosed
WO-2021230714-A1 ORGANIC LIGHT-EMITTING ELEMENT 주식회사 엘지화학 2021-11-18 WO disclosed
WO-2021080340-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DIODE USING SAME 주식회사 엘지화학 2021-04-29 WO disclosed
WO-2021080339-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DIODE USING SAME 주식회사 엘지화학 2021-04-29 WO disclosed
WO-2020159335-A1 COMPOUND AND ORGANIC LIGHT EMITTING DIODE COMPRISING SAME 주식회사 엘지화학 2020-08-06 WO disclosed
WO-2020159334-A1 COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME 주식회사 엘지화학 2020-08-06 WO disclosed
WO-2020159332-A1 COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2020-08-06 WO disclosed
WO-2020159337-A1 COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2020-08-06 WO disclosed
WO-2020159333-A1 COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2020-08-06 WO disclosed
WO-2020159340-A1 COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2020-08-06 WO disclosed
WO-2020159336-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING SAME 주식회사 엘지화학 2020-08-06 WO disclosed