SCHEMBL21763771

SCHEMBL21763771

c1ccc(-c2cccc(-c3c4ccccc4c(-c4cccc(-c5cccc6oc7ccccc7c56)c4)c4ccccc34)c2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PLA2G2A P14555 4/20 0.43
▸ PLA2G4A P47712 4/20 0.43
▸ PLA2G10 O15496 1/20 0.40
▸ ALOX5 P09917 1/20 0.39
▸ HPGD P15428 3/20 0.38
▸ SMN1; SMN2 Q16637 3/20 0.38
▸ CA1 P00915 2/20 0.38
▸ CA2 P00918 2/20 0.38
▸ CYP3A4 P08684 2/20 0.38
▸ NPC1 O15118 2/20 0.38
▸ RAB9A P51151 2/20 0.38
▸ GABRP O00591 1/20 0.38
▸ GABRD O14764 1/20 0.38
▸ CA12 O43570 1/20 0.38
▸ TNKS O95271 1/20 0.38
▸ TP53 P04637 1/20 0.38
▸ ABCB1 P08183 1/20 0.38
▸ PARP1 P09874 1/20 0.38
▸ ADORA3 P0DMS8 1/20 0.38
▸ AR P10275 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
SCHEMBL19764777 0.95 CA1 (0.41) PLA2G2APLA2G4APLA2G10ALOX5HPGD
SCHEMBL22936532 0.94 PLA2G2A (0.43) PLA2G2APLA2G4APLA2G10ALOX5HPGD
SCHEMBL22062618 0.94 PLA2G2A (0.44) PLA2G2APLA2G4APLA2G10ALOX5HPGD
SCHEMBL20650703 0.94 PLA2G2A (0.43) PLA2G2APLA2G4APLA2G10ALOX5HPGD
SCHEMBL25680438 0.94 PLA2G2A (0.47) PLA2G2APLA2G4APLA2G10ALOX5HPGD
SCHEMBL23637540 0.93 PLA2G2A (0.42) PLA2G2APLA2G4APLA2G10ALOX5HPGD
SCHEMBL22180601 0.93 PLA2G2A (0.42) PLA2G2APLA2G4APLA2G10ALOX5HPGD
SCHEMBL25624638 0.93 PLA2G2A (0.42) PLA2G2APLA2G4APLA2G10ALOX5HPGD
SCHEMBL23772156 0.93 PLA2G2A (0.42) PLA2G2APLA2G4APLA2G10ALOX5HPGD
SCHEMBL19764772 0.91 PLA2G2A (0.46) PLA2G2APLA2G4APLA2G10ALOX5HPGD

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-2020040514-A1 ORGANIC LIGHT EMITTING DIODE 주식회사 엘지화학 2020-02-27 — — WO disclosed
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