SCHEMBL24748255

SCHEMBL24748255

c1ccc(-c2ccc(-c3cccc4ccccc34)cc2N(c2cccc(-c3ccc4oc5ccccc5c4c3)c2)c2cccc3oc4ccccc4c23)cc1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MCL1 Q07820 1/20 0.34
▸ ACMSD Q8TDX5 1/20 0.34
▸ 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
▸ ALOX5 P09917 1/20 0.32
▸ CASP3 P42574 1/20 0.32
▸ SENP7 Q9BQF6 1/20 0.32
▸ SENP6 Q9GZR1 1/20 0.32
▸ HSP90AA1 P07900 1/20 0.31
▸ HSP90AB1 P08238 1/20 0.31
▸ KDM4E B2RXH2 2/20 0.31
▸ ALDH1A1 P00352 2/20 0.31
▸ MAPT P10636 2/20 0.31
▸ HPGD P15428 2/20 0.31
▸ ALOX15 P16050 1/20 0.31

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
SCHEMBL24747658 0.95 MCL1 (0.36) MCL1ACMSDCA12CA1CA2
SCHEMBL24748258 0.94 CA12 (0.36) MCL1ACMSDCA12CA1CA2
SCHEMBL24748257 0.94 MCL1 (0.34) MCL1ACMSDCA12CA1CA2
SCHEMBL24963970 0.94 CA12 (0.37) MCL1ACMSDCA12CA1CA2
SCHEMBL22523677 0.93 MCL1 (0.35) MCL1ACMSDCA12CA1CA2
SCHEMBL24749704 0.92 MCL1 (0.34) MCL1ACMSDCA12CA1CA2
SCHEMBL24747667 0.92 MCL1 (0.37) MCL1ACMSDCA12CA1CA2
SCHEMBL24748221 0.92 MCL1 (0.36) MCL1ACMSDCA12CA1CA2
SCHEMBL22523206 0.92 MCL1 (0.36) MCL1ACMSDCA12CA1CA2
SCHEMBL24751238 0.91 PLA2G2A (0.33) PLA2G2APLA2G4APLA2G10CASP3SENP7

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-2022259886-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE 出光興産株式会社 2022-12-15 — — WO disclosed
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