SCHEMBL27288592

SCHEMBL27288592

c1ccc(-c2oc3c(ccc4sc5ccccc5c43)c2-c2c3ccccc3c(-c3ccc4c(ccc5oc6ccccc6c54)c3)c3ccccc23)cc1

nearest known ligand 0.32

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ABCG2 Q9UNQ0 3/20 0.32
▸ PLA2G2A P14555 1/20 0.31
▸ PLA2G4A P47712 1/20 0.31
▸ CYP1A1 P04798 1/20 0.30
▸ CYP1A2 P05177 1/20 0.30
▸ FYN P06241 1/20 0.30
▸ MAPK3 P27361 1/20 0.30
▸ AHR P35869 1/20 0.30
▸ PAX8 Q06710 1/20 0.30
▸ TDP1 Q9NUW8 1/20 0.30
▸ L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL27287149 0.89 ABCG2 (0.37) ABCG2PLA2G2APLA2G4ACYP1A1CYP1A2
SCHEMBL27288769 0.84 ABCG2 (0.35) ABCG2CYP1A1CYP1A2FYNMAPK3
SCHEMBL27288240 0.82 ABCG2 (0.32) ABCG2PLA2G2APLA2G4ACYP1A1CYP1A2
SCHEMBL20127487 0.82 TDP1 (0.37) ABCG2PLA2G2APLA2G4ACYP1A1CYP1A2
SCHEMBL19110008 0.78 PGR (0.34) ABCG2PLA2G2APLA2G4ACYP1A1CYP1A2
SCHEMBL27286753 0.78 ABCG2 (0.36) ABCG2PLA2G2APLA2G4ACYP1A1CYP1A2
SCHEMBL20127342 0.78 TDP1 (0.43) ABCG2PLA2G2APLA2G4ACYP1A1CYP1A2
SCHEMBL17932077 0.78 ESR2 (0.34) PLA2G2APLA2G4ACYP1A1CYP1A2TDP1
SCHEMBL27288768 0.77 ABCG2 (0.33) ABCG2CYP1A1CYP1A2FYNMAPK3
SCHEMBL26492283 0.77 PGR (0.37) ABCG2PLA2G2APLA2G4ACYP1A1CYP1A2

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-2024010167-A1 COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME 주식회사 엘지화학 2024-01-11 — — WO disclosed
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