SCHEMBL26154238

SCHEMBL26154238

c1cc(-c2ccc3oc4ccccc4c3c2)cc(N(c2ccc(-c3cccc4ccccc34)cc2)c2cccc(-c3cccc4ccccc34)c2)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 2/20 0.40
▸ CA1 P00915 2/20 0.40
▸ CA2 P00918 2/20 0.40
▸ CA9 Q16790 2/20 0.40
▸ MCL1 Q07820 1/20 0.38
▸ ACMSD Q8TDX5 1/20 0.38
▸ ALOX5 P09917 1/20 0.38
▸ CASP3 P42574 1/20 0.37
▸ SENP7 Q9BQF6 1/20 0.37
▸ SENP6 Q9GZR1 1/20 0.37
▸ PLA2G2A P14555 3/20 0.36
▸ PLA2G4A P47712 3/20 0.36
▸ PLA2G10 O15496 1/20 0.36
▸ ALDH1A1 P00352 4/20 0.36
▸ MAPT P10636 3/20 0.36
▸ HPGD P15428 3/20 0.36
▸ KDM4E B2RXH2 3/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ RAB9A P51151 2/20 0.36

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
SCHEMBL29310744 0.99 CA12 (0.40) CA12CA1CA2CA9MCL1
SCHEMBL23224532 0.98 CA12 (0.40) CA12CA1CA2CA9MCL1
SCHEMBL10110188 0.98 CA12 (0.42) CA12CA1CA2CA9MCL1
SCHEMBL18854403 0.98 CA12 (0.40) CA12CA1CA2CA9MCL1
SCHEMBL23224833 0.96 PLA2G2A (0.40) CA12CA1CA2CA9MCL1
SCHEMBL23224535 0.96 CA12 (0.39) CA12CA1CA2CA9MCL1
SCHEMBL24919394 0.96 PLA2G2A (0.40) CA12CA1CA2CA9MCL1
SCHEMBL23224489 0.96 PLA2G2A (0.40) CA12CA1CA2CA9MCL1
SCHEMBL24919282 0.96 PLA2G2A (0.40) CA12CA1CA2CA9MCL1
SCHEMBL10110403 0.96 CA12 (0.41) 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-2023085606-A1 ORGANIC ELECTRIC ELEMENT COMPRISING COMPOUND FOR ORGANIC ELECTRIC ELEMENT, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2023-05-19 — — WO disclosed
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