SCHEMBL24748810

SCHEMBL24748810

c1ccc(-c2ccc(-c3cccc4ccccc34)cc2N(c2ccc(-c3cc4ccccc4c4ccccc34)cc2)c2cccc3oc4ccccc4c23)cc1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MCL1 Q07820 1/20 0.33
▸ ACMSD Q8TDX5 1/20 0.33
▸ ALDH1A1 P00352 4/20 0.33
▸ KDM4E B2RXH2 3/20 0.33
▸ HPGD P15428 3/20 0.33
▸ MEN1 O00255 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ MAPT P10636 2/20 0.33
▸ MPI P34949 1/20 0.33
▸ CA12 O43570 2/20 0.32
▸ CA1 P00915 2/20 0.32
▸ CA2 P00918 2/20 0.32
▸ CA9 Q16790 2/20 0.32
▸ RAB9A P51151 2/20 0.32
▸ MAOB P27338 1/20 0.32
▸ TSHR P16473 2/20 0.32
▸ MAPK1 P28482 2/20 0.32
▸ HSD17B10 Q99714 2/20 0.32
▸ L3MBTL1 Q9Y468 2/20 0.32
▸ CASP1 P29466 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
SCHEMBL24749520 0.95 TDP1 (0.34) MCL1ACMSDALDH1A1KDM4EHPGD
SCHEMBL23238223 0.94 CA12 (0.33) MCL1ACMSDALDH1A1KDM4EHPGD
SCHEMBL24748246 0.94 CA12 (0.37) MCL1ACMSDALDH1A1KDM4EHPGD
SCHEMBL24748234 0.94 CA12 (0.37) MCL1ACMSDALDH1A1KDM4EHPGD
SCHEMBL24748236 0.94 CA12 (0.37) MCL1ACMSDALDH1A1KDM4EHPGD
SCHEMBL24748143 0.93 ALDH1A1 (0.33) MCL1ACMSDALDH1A1KDM4EHPGD
SCHEMBL24749421 0.93 ALDH1A1 (0.33) MCL1ACMSDALDH1A1KDM4EHPGD
SCHEMBL24749479 0.93 TDP1 (0.34) MCL1ACMSDALDH1A1KDM4EHPGD
SCHEMBL24748261 0.93 MCL1 (0.34) MCL1ACMSDALDH1A1KDM4EHPGD
SCHEMBL24748221 0.93 MCL1 (0.36) MCL1ACMSDALDH1A1KDM4EHPGD

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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