SCHEMBL22330168

SCHEMBL22330168

c1ccc(-c2cccc(-c3nc(-c4ccccc4)nc(-c4ccc5c(c4)sc4c(-c6nc(-c7ccccc7)nc(-c7ccccc7)n6)cccc45)n3)c2)cc1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LIMK1 P53667 11/20 0.43
ALOX5 P09917 1/20 0.43
LIMK2 P53671 2/20 0.38
PIK3CA P42336 1/20 0.38
PI4KA P42356 1/20 0.38
PI4KB Q9UBF8 1/20 0.38
ADORA2A P29274 2/20 0.35
ADORA1 P30542 2/20 0.35
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 1/20 0.35
MAPT P10636 1/20 0.35
HPGD P15428 1/20 0.35
KMT2A Q03164 1/20 0.35
ADORA3 P0DMS8 1/20 0.35
ALOX15 P16050 1/20 0.35
TSHR P16473 1/20 0.35
ADORA2B P29275 1/20 0.35
PIM3 Q86V86 1/20 0.34

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
SCHEMBL25645925 1.00 LIMK1 (0.43) LIMK1ALOX5LIMK2PIK3CAPI4KA
SCHEMBL22329398 1.00 LIMK1 (0.43) LIMK1ALOX5LIMK2PIK3CAPI4KA
SCHEMBL24216624 0.99 LIMK1 (0.44) LIMK1ALOX5LIMK2PIK3CAPI4KA
SCHEMBL25645997 0.99 LIMK1 (0.44) LIMK1ALOX5LIMK2PIK3CAPI4KA
SCHEMBL22329976 0.97 ALOX5 (0.45) LIMK1ALOX5LIMK2PIK3CAPI4KA
SCHEMBL24216660 0.97 LIMK1 (0.45) LIMK1ALOX5LIMK2PIK3CAPI4KA
SCHEMBL22329620 0.97 LIMK1 (0.45) LIMK1ALOX5LIMK2PIK3CAPI4KA
SCHEMBL24216629 0.97 LIMK1 (0.45) LIMK1ALOX5LIMK2PIK3CAPI4KA
SCHEMBL22700444 0.97 ALOX5 (0.45) LIMK1ALOX5LIMK2PIK3CAPI4KA
SCHEMBL22330202 0.97 ALOX5 (0.45) LIMK1ALOX5LIMK2PIK3CAPI4KA

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
US-11581494-B2 Organic light emitting device LG CHEM, LTD. (KR) 2023-02-14 US disclosed
US-20200259098-A1 ORGANIC LIGHT EMITTING DEVICE LG CHEM, LTD. (KR) 2020-08-13 US disclosed