SCHEMBL29303497

SCHEMBL29303497

c1ccc(-c2cccc(-c3cccc(N(c4ccc(-c5ccc6cccc(-c7ccccc7)c6c5)cc4)c4ccc5c(c4)oc4ccccc45)c3)c2)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 2/20 0.37
▸ CA1 P00915 2/20 0.37
▸ CA2 P00918 2/20 0.37
▸ CA9 Q16790 2/20 0.37
▸ PLA2G2A P14555 3/20 0.36
▸ PLA2G4A P47712 3/20 0.36
▸ PLA2G10 O15496 1/20 0.36
▸ CYP1A1 P04798 1/20 0.35
▸ CYP1A2 P05177 1/20 0.35
▸ CYP1B1 Q16678 1/20 0.35
▸ HCRTR1 O43613 1/20 0.34
▸ DUSP3 P51452 1/20 0.34
▸ MMP12 P39900 1/20 0.34
▸ MMP13 P45452 1/20 0.34
▸ AHR P35869 1/20 0.33
▸ MCL1 Q07820 1/20 0.33
▸ ACMSD Q8TDX5 1/20 0.33
▸ ALOX5 P09917 1/20 0.33
▸ KDM4E B2RXH2 2/20 0.33
▸ ALDH1A1 P00352 2/20 0.33

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
SCHEMBL29303531 0.99 CA12 (0.36) CA12CA1CA2CA9PLA2G2A
SCHEMBL21214789 0.98 CA12 (0.38) CA12CA1CA2CA9PLA2G2A
SCHEMBL21214791 0.98 CA12 (0.39) CA12CA1CA2CA9PLA2G2A
SCHEMBL29303827 0.97 CA12 (0.35) CA12CA1CA2CA9PLA2G2A
SCHEMBL21203483 0.97 CA12 (0.39) CA12CA1CA2CA9PLA2G2A
SCHEMBL21203451 0.97 CA12 (0.39) CA12CA1CA2CA9PLA2G2A
SCHEMBL21206097 0.97 CA12 (0.39) CA12CA1CA2CA9PLA2G2A
SCHEMBL21123729 0.96 CA12 (0.39) CA12CA1CA2CA9PLA2G2A
SCHEMBL21214790 0.96 CA12 (0.39) CA12CA1CA2CA9PLA2G2A
SCHEMBL21214817 0.95 CA12 (0.41) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240237528-A1 LIGHT EMITTING ELEMENT AND AMINE COMPOUND FOR THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2024-07-11 — — US disclosed
US-20240237528-A1 LIGHT EMITTING ELEMENT AND AMINE COMPOUND FOR THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2024-07-11 — — US disclosed
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