SCHEMBL25600082

SCHEMBL25600082

c1ccc(-c2ccc(N(c3ccc4oc5ccc6c(ccc7oc8ccccc8c76)c5c4c3)c3cccc4c3oc3ccccc34)cc2)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 3/20 0.36
▸ PLA2G2A P14555 4/20 0.34
▸ PLA2G4A P47712 4/20 0.34
▸ PLA2G10 O15496 1/20 0.33
▸ MEN1 O00255 4/20 0.32
▸ MAPT P10636 4/20 0.32
▸ KMT2A Q03164 4/20 0.32
▸ HPGD P15428 4/20 0.32
▸ KDM4E B2RXH2 3/20 0.32
▸ ALDH1A1 P00352 2/20 0.32
▸ AHR P35869 2/20 0.32
▸ NPC1 O15118 2/20 0.32
▸ RAB9A P51151 2/20 0.32
▸ SMN1; SMN2 Q16637 2/20 0.32
▸ CYP3A4 P08684 2/20 0.32
▸ ALPI P09923 1/20 0.32
▸ GAA P10253 1/20 0.32
▸ PKM P14618 1/20 0.32
▸ CASP3 P42574 1/20 0.32
▸ RECQL P46063 1/20 0.32

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
SCHEMBL25600086 0.95 ALOX5 (0.36) ALOX5PLA2G2APLA2G4APLA2G10MEN1
SCHEMBL27010875 0.94 ALOX5 (0.36) ALOX5PLA2G2APLA2G4APLA2G10MEN1
SCHEMBL25599659 0.94 MAPT (0.34) ALOX5MEN1MAPTKMT2AHPGD
SCHEMBL15851822 0.92 ALOX5 (0.34) ALOX5PLA2G2APLA2G4APLA2G10MEN1
SCHEMBL25870291 0.92 ALOX5 (0.36) ALOX5PLA2G2APLA2G4APLA2G10MEN1
SCHEMBL15964369 0.92 ALOX5 (0.40) ALOX5PLA2G2APLA2G4APLA2G10MEN1
SCHEMBL15964376 0.92 ALOX5 (0.40) ALOX5PLA2G2APLA2G4APLA2G10MEN1
SCHEMBL25515807 0.91 ALOX5 (0.35) ALOX5PLA2G2APLA2G4APLA2G10MEN1
SCHEMBL15851909 0.91 ABCG2 (0.38) ALOX5PLA2G2APLA2G4APLA2G10MAPT
SCHEMBL24199087 0.91 MMP12 (0.37) ALOX5PLA2G2APLA2G4APLA2G10MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023096426-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT USING SAME 주식회사 엘지화학 2023-06-01 — — WO disclosed
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