SCHEMBL25797765

SCHEMBL25797765

c1ccc(-c2oc3ccc(-c4c5ccccc5c(-c5cccc6oc7ccccc7c56)c5ccccc45)cc3c2-c2ccccc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PLA2G2A P14555 3/20 0.43
▸ PLA2G4A P47712 3/20 0.43
▸ L3MBTL1 Q9Y468 3/20 0.40
▸ PTGS2 P35354 5/20 0.38
▸ PTGS1 P23219 1/20 0.38
▸ PLA2G10 O15496 1/20 0.38
▸ DDR2 Q16832 1/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ CA12 O43570 1/20 0.37
▸ CA1 P00915 1/20 0.37
▸ CA2 P00918 1/20 0.37
▸ LMNA P02545 1/20 0.37
▸ TP53 P04637 1/20 0.37
▸ ABCB1 P08183 1/20 0.37
▸ CYP3A4 P08684 1/20 0.37
▸ CALM1 P0DP23 1/20 0.37
▸ AR P10275 1/20 0.37
▸ PKM P14618 1/20 0.37
▸ ALOX15 P16050 1/20 0.37

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
SCHEMBL23428146 0.91 PLA2G2A (0.42) PLA2G2APLA2G4AL3MBTL1PLA2G10KDM4E
SCHEMBL23426852 0.89 PLA2G2A (0.43) PLA2G2APLA2G4AL3MBTL1PLA2G10KDM4E
SCHEMBL23428359 0.88 PLA2G2A (0.43) PLA2G2APLA2G4AL3MBTL1PLA2G10KDM4E
SCHEMBL23427616 0.88 PLA2G2A (0.43) PLA2G2APLA2G4AL3MBTL1PLA2G10KDM4E
SCHEMBL27331571 0.87 PLA2G2A (0.43) PLA2G2APLA2G4AL3MBTL1PTGS2PTGS1
SCHEMBL25871312 0.87 PLA2G2A (0.41) PLA2G2APLA2G4AL3MBTL1PLA2G10KDM4E
SCHEMBL23427353 0.87 NPC1 (0.41) PLA2G2APLA2G4APLA2G10KDM4EMEN1
SCHEMBL12768092 0.86 ABCG2 (0.44) PLA2G2APLA2G4AL3MBTL1KDM4EALOX15
SCHEMBL27327416 0.86 PLA2G2A (0.39) PLA2G2APLA2G4AL3MBTL1PTGS2PTGS1
SCHEMBL23426935 0.86 ALOX5 (0.40) PLA2G2APLA2G4AL3MBTL1PLA2G10KDM4E

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-2023132489-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2023-07-13 — — WO disclosed
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