SCHEMBL22329976

SCHEMBL22329976

c1ccc(-c2ccc(-c3nc(-c4ccccc4)nc(-c4cccc5c4sc4cc(-c6nc(-c7ccccc7)nc(-c7ccccc7)n6)ccc45)n3)cc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.45
LIMK1 P53667 8/20 0.42
ADORA2A P29274 2/20 0.37
ADORA1 P30542 2/20 0.37
MEN1 O00255 3/20 0.36
ALDH1A1 P00352 3/20 0.36
MAPT P10636 3/20 0.36
HPGD P15428 3/20 0.36
KMT2A Q03164 3/20 0.36
TSHR P16473 2/20 0.36
ADORA3 P0DMS8 1/20 0.36
ALOX15 P16050 1/20 0.36
ADORA2B P29275 1/20 0.36
PIK3CA P42336 1/20 0.36
PI4KA P42356 1/20 0.36
PI4KB Q9UBF8 1/20 0.36
KDM4E B2RXH2 2/20 0.35
ATM Q13315 2/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
TP53 P04637 1/20 0.35

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
SCHEMBL22700444 1.00 ALOX5 (0.45) ALOX5LIMK1ADORA2AADORA1MEN1
SCHEMBL22330202 1.00 ALOX5 (0.45) ALOX5LIMK1ADORA2AADORA1MEN1
SCHEMBL22329392 0.99 ALOX5 (0.46) ALOX5LIMK1ADORA2AADORA1MEN1
SCHEMBL25645925 0.97 LIMK1 (0.43) ALOX5LIMK1ADORA2AADORA1MEN1
SCHEMBL22330168 0.97 LIMK1 (0.43) ALOX5LIMK1ADORA2AADORA1MEN1
SCHEMBL22329398 0.97 LIMK1 (0.43) ALOX5LIMK1ADORA2AADORA1MEN1
SCHEMBL24216660 0.97 LIMK1 (0.45) ALOX5LIMK1ADORA2AADORA1MEN1
SCHEMBL22329620 0.97 LIMK1 (0.45) ALOX5LIMK1ADORA2AADORA1MEN1
SCHEMBL24216629 0.97 LIMK1 (0.45) ALOX5LIMK1ADORA2AADORA1MEN1
SCHEMBL25645924 0.97 LIMK1 (0.45) ALOX5LIMK1ADORA2AADORA1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11581494-B2 Organic light emitting device LG CHEM, LTD. (KR) 2023-02-14 US disclosed
WO-2020235976-A1 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME 주식회사 엘지화학 (KR) 2020-11-26 WO disclosed
US-20200259098-A1 ORGANIC LIGHT EMITTING DEVICE LG CHEM, LTD. (KR) 2020-08-13 US disclosed