SCHEMBL27360930

SCHEMBL27360930

c1ccc(-c2cccc(N(c3ccc(-c4ccccc4-n4c5ccccc5c5ccccc54)c(-c4ccccc4)c3)c3ccccc3-c3ccc(-c4cccc5ccccc45)cc3)c2)cc1

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 2/20 0.36
▸ CA1 P00915 2/20 0.36
▸ CA2 P00918 2/20 0.36
▸ CA9 Q16790 2/20 0.36
▸ MCL1 Q07820 1/20 0.32
▸ ACMSD Q8TDX5 1/20 0.32

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
SCHEMBL27360927 1.00 CA12 (0.36) CA12CA1CA2CA9MCL1
SCHEMBL27360928 0.96 CA12 (0.36) CA12CA1CA2CA9MCL1
SCHEMBL27360933 0.96 MCL1 (0.33) CA12CA1CA2CA9MCL1
SCHEMBL27360618 0.96 CA12 (0.35) CA12CA1CA2CA9MCL1
SCHEMBL27360935 0.96 CA12 (0.35) CA12CA1CA2CA9MCL1
SCHEMBL27360625 0.95 CA12 (0.35) CA12CA1CA2CA9MCL1
SCHEMBL24949305 0.95 MCL1 (0.34) CA12CA1CA2CA9MCL1
SCHEMBL24949667 0.94 CA12 (0.35) CA12CA1CA2CA9MCL1
SCHEMBL27360923 0.94 CA12 (0.39) CA12CA1CA2CA9MCL1
SCHEMBL27360931 0.94 MCL1 (0.34) CA12CA1CA2CA9MCL1

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-2024014660-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2024-01-18 — — WO disclosed
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