SCHEMBL27323296

SCHEMBL27323296

c1cc(-c2ccc(N(c3ccccc3-c3ccc4oc5cc6ccccc6cc5c4c3)c3cccc4oc5ccccc5c34)cc2)cc(-c2cccc3ccccc23)c1

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 1/20 0.34
▸ CA1 P00915 1/20 0.34
▸ CA2 P00918 1/20 0.34
▸ CA9 Q16790 1/20 0.34
▸ PLA2G2A P14555 3/20 0.33
▸ PLA2G4A P47712 3/20 0.33
▸ PLA2G10 O15496 1/20 0.33
▸ MCL1 Q07820 1/20 0.30
▸ ACMSD Q8TDX5 1/20 0.30
▸ ALOX5 P09917 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
SCHEMBL27322741 0.96 CA12 (0.33) CA12CA1CA2CA9MCL1
SCHEMBL24964559 0.95 CA12 (0.36) CA12CA1CA2CA9PLA2G2A
SCHEMBL23239083 0.95 CA12 (0.36) CA12CA1CA2CA9PLA2G2A
SCHEMBL27332127 0.94 ALOX5 (0.34) PLA2G2APLA2G4APLA2G10ALOX5
SCHEMBL27323398 0.93 CA12 (0.35) CA12CA1CA2CA9PLA2G2A
SCHEMBL27308650 0.93 CA12 (0.36) CA12CA1CA2CA9PLA2G2A
SCHEMBL27308648 0.93 CA12 (0.38) CA12CA1CA2CA9PLA2G2A
SCHEMBL27332121 0.92 ALOX5 (0.33) PLA2G2APLA2G4APLA2G10ALOX5
SCHEMBL23237800 0.92 CA12 (0.38) CA12CA1CA2CA9PLA2G2A
SCHEMBL27323397 0.91 CA12 (0.34) CA12CA1CA2CA9PLA2G2A

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-2023199832-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE 出光興産株式会社 2023-10-19 — — WO disclosed
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