SCHEMBL26429231

SCHEMBL26429231

CC1(C)OB(c2ccc(N(c3ccc(B4OC(C)(C)C(C)(C)O4)cc3)c3cccc(-c4ccc5c(c4)CC5)c3)cc2)OC1(C)C

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ LIPG Q9Y5X9 14/20 0.48
▸ LPL P06858 13/20 0.48
▸ CYP11B1 P15538 1/20 0.33
▸ CYP11B2 P19099 1/20 0.33
▸ BACE1 P56817 1/20 0.32
▸ SNCA P37840 1/20 0.32
▸ CA1 P00915 2/20 0.32
▸ CA2 P00918 2/20 0.32
▸ CA9 Q16790 2/20 0.32
▸ KEAP1 Q14145 1/20 0.32
▸ NFE2L2 Q16236 1/20 0.32
▸ CA12 O43570 1/20 0.32
▸ CA3 P07451 1/20 0.32
▸ CA4 P22748 1/20 0.32
▸ CA6 P23280 1/20 0.32
▸ CA5A P35218 1/20 0.32
▸ CA7 P43166 1/20 0.32
▸ CA14 Q9ULX7 1/20 0.32
▸ CA5B Q9Y2D0 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
SCHEMBL20320245 0.91 LIPG (0.50) LIPGLPLBACE1SNCACA1
SCHEMBL20233442 0.87 LIPG (0.44) LIPGLPLBACE1CA1CA2
SCHEMBL21838408 0.86 LIPG (0.67) LIPGLPLSNCACA1CA2
SCHEMBL24531331 0.86 LIPG (0.67) LIPGLPLSNCACA1CA2
SCHEMBL26416400 0.84 LIPG (0.64) LIPGLPLCA1CA2CA9
SCHEMBL16639374 0.82 LIPG (0.50) LIPGLPLCYP11B1CYP11B2BACE1
SCHEMBL26082913 0.80 CYP11B1 (0.40) CYP11B1CYP11B2
SCHEMBL16383444 0.80 LIPG (0.56) LIPGLPLKEAP1NFE2L2
SCHEMBL17667138 0.79 LIPG (0.77) LIPGLPLCA1CA2CA9
SCHEMBL20806544 0.79 LIPG (0.77) LIPGLPLCA1CA2CA9

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-2023182377-A1 HIGH-MOLECULAR-WEIGHT TRIARYLAMINE COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT 保土谷化学工業株式会社 2023-09-28 — — WO disclosed
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