SCHEMBL22329779

SCHEMBL22329779

c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-c4ccc5sc6c(-c7nc(-c8ccccc8)nc(-c8ccccc8)n7)cccc6c5c4)cc3)n2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIMK1 P53667 3/20 0.45
ALOX5 P09917 1/20 0.45
PIM3 Q86V86 2/20 0.41
PIM1 P11309 2/20 0.40
PIM2 Q9P1W9 2/20 0.40
ROCK1 Q13464 1/20 0.38
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

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
SCHEMBL17425622 1.00 LIMK1 (0.45) LIMK1ALOX5PIM3PIM1PIM2
SCHEMBL25645920 1.00 LIMK1 (0.45) LIMK1ALOX5PIM3PIM1PIM2
SCHEMBL17425601 1.00 LIMK1 (0.45) LIMK1ALOX5PIM3PIM1PIM2
SCHEMBL25645923 1.00 LIMK1 (0.45) LIMK1ALOX5PIM3PIM1PIM2
SCHEMBL17425602 0.99 LIMK1 (0.44) LIMK1ALOX5PIM3PIM1PIM2
SCHEMBL22330086 0.97 LIMK1 (0.43) LIMK1ALOX5PIM3PIM1PIM2
SCHEMBL22330124 0.97 LIMK1 (0.43) LIMK1ALOX5PIM3PIM1PIM2
SCHEMBL26709728 0.97 ALOX5 (0.49) LIMK1ALOX5PIM3PIM1PIM2
SCHEMBL25645921 0.97 LIMK1 (0.43) LIMK1ALOX5PIM3PIM1PIM2
SCHEMBL22700404 0.97 ALOX5 (0.45) LIMK1ALOX5PIM3PIM1PIM2

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