SCHEMBL22329920

SCHEMBL22329920

c1ccc(-c2nc(-c3ccc4oc5ccccc5c4c3)nc(-c3cccc4c3sc3cccc(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)c34)n2)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIMK1 P53667 3/20 0.36
ALOX5 P09917 2/20 0.36
CHEK2 O96017 1/20 0.35
PLA2G2A P14555 2/20 0.34
PLA2G4A P47712 2/20 0.34
PLA2G10 O15496 1/20 0.34
ALDH1A1 P00352 5/20 0.34
HPGD P15428 5/20 0.34
KDM4E B2RXH2 5/20 0.34
MAPT P10636 4/20 0.34
HSD17B10 Q99714 3/20 0.34
TSHR P16473 2/20 0.34
ALOX15 P16050 1/20 0.34
CASP1 P29466 1/20 0.34
CASP7 P55210 1/20 0.34
HSP90AA1 P07900 1/20 0.34
HSP90AB1 P08238 1/20 0.34
SMN1; SMN2 Q16637 3/20 0.34
KMT2A Q03164 2/20 0.34
NPC1 O15118 2/20 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
SCHEMBL24841669 0.93 LIMK1 (0.40) LIMK1ALOX5PLA2G2APLA2G4APLA2G10
SCHEMBL22700539 0.93 PRKDC (0.38) LIMK1ALOX5ALDH1A1HPGDKDM4E
SCHEMBL22329417 0.93 PRKDC (0.38) LIMK1ALOX5ALDH1A1HPGDKDM4E
SCHEMBL21707324 0.92 ALOX5 (0.44) LIMK1ALOX5CHEK2PLA2G2APLA2G4A
SCHEMBL21707328 0.92 CHEK2 (0.35) LIMK1ALOX5CHEK2PLA2G2APLA2G4A
SCHEMBL22592860 0.92 LIMK1 (0.35) LIMK1ALOX5CHEK2PLA2G2APLA2G4A
SCHEMBL22329590 0.91 CHEK2 (0.35) LIMK1ALOX5CHEK2PLA2G2APLA2G4A
SCHEMBL22329849 0.91 LIMK1 (0.36) LIMK1ALOX5ALDH1A1HPGDKDM4E
SCHEMBL22329414 0.91 LIMK1 (0.36) LIMK1ALOX5ALDH1A1HPGDKDM4E
SCHEMBL23686625 0.90 LIMK1 (0.33) LIMK1ALOX5CHEK2ALDH1A1HPGD

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