SCHEMBL27360590

SCHEMBL27360590

c1ccc(-c2oc3cc(-c4c5ccccc5c(-c5cccc6oc7ccccc7c56)c5ccccc45)c4ccccc4c3c2-c2ccccc2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PLA2G2A P14555 1/20 0.42
▸ PLA2G4A P47712 1/20 0.42
▸ MEN1 O00255 4/20 0.39
▸ KMT2A Q03164 4/20 0.39
▸ HSP90AA1 P07900 1/20 0.39
▸ CA1 P00915 3/20 0.38
▸ CA2 P00918 3/20 0.38
▸ CYP3A4 P08684 3/20 0.38
▸ LMNA P02545 2/20 0.38
▸ KDM4E B2RXH2 2/20 0.38
▸ CA12 O43570 2/20 0.38
▸ TP53 P04637 2/20 0.38
▸ ABCB1 P08183 2/20 0.38
▸ AR P10275 2/20 0.38
▸ CYP1B1 Q16678 2/20 0.38
▸ CA9 Q16790 2/20 0.38
▸ ADORA3 P0DMS8 2/20 0.38
▸ DDR2 Q16832 1/20 0.38
▸ CALM1 P0DP23 1/20 0.38
▸ PKM P14618 1/20 0.38

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
SCHEMBL12623253 0.85 PLA2G2A (0.43) PLA2G2APLA2G4AMEN1KMT2AHSP90AA1
SCHEMBL27331571 0.84 PLA2G2A (0.43) PLA2G2APLA2G4AMEN1KMT2AHSP90AA1
SCHEMBL25797765 0.84 PLA2G2A (0.43) PLA2G2APLA2G4AMEN1KMT2ACA1
SCHEMBL22954101 0.84 PLA2G2A (0.43) PLA2G2APLA2G4AMEN1KMT2AHSP90AA1
SCHEMBL29598588 0.84 PLA2G2A (0.43) PLA2G2APLA2G4AMEN1KMT2AHSP90AA1
SCHEMBL30868646 0.84 CA1 (0.44) PLA2G2APLA2G4AMEN1KMT2ACA1
SCHEMBL18382835 0.84 CA1 (0.44) PLA2G2APLA2G4AMEN1KMT2ACA1
SCHEMBL17944866 0.82 CA1 (0.42) PLA2G2APLA2G4AMEN1KMT2ACA1
SCHEMBL23426751 0.82 CA1 (0.42) PLA2G2APLA2G4AMEN1KMT2ACA1
SCHEMBL27357257 0.82 ABCG2 (0.44) MEN1KMT2ACA1CA2CYP3A4

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-2024005431-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2024-01-04 — — WO disclosed
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