SCHEMBL25870444

SCHEMBL25870444

c1ccc2c(-c3ccc(N(c4ccc5ccc6oc7ccccc7c6c5c4)c4cccc5oc6ccccc6c45)cc3)cccc2c1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 2/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ MCL1 Q07820 1/20 0.34
▸ ACMSD Q8TDX5 1/20 0.34
▸ ENPP3 O14638 1/20 0.34
▸ ENPP1 P22413 1/20 0.34
▸ CA12 O43570 2/20 0.33
▸ CA1 P00915 2/20 0.33
▸ CA2 P00918 2/20 0.33
▸ CA9 Q16790 2/20 0.33
▸ ABCG2 Q9UNQ0 3/20 0.33
▸ ALDH1A1 P00352 3/20 0.33
▸ MAPT P10636 3/20 0.33
▸ HSD17B10 Q99714 3/20 0.33
▸ MEN1 O00255 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ HPGD P15428 2/20 0.33
▸ HDAC8 Q9BY41 1/20 0.33
▸ HDAC6 Q9UBN7 1/20 0.33
▸ RAB9A P51151 2/20 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
SCHEMBL26490506 0.95 TDP1 (0.35) TDP1L3MBTL1MCL1ACMSDENPP3
SCHEMBL25870448 0.94 CA12 (0.38) TDP1L3MBTL1ENPP3ENPP1CA12
SCHEMBL24658096 0.94 TDP1 (0.36) TDP1L3MBTL1MCL1ACMSDENPP3
SCHEMBL25730831 0.94 TDP1 (0.35) TDP1L3MBTL1MCL1ACMSDENPP3
SCHEMBL23867349 0.94 ALDH1A1 (0.35) TDP1L3MBTL1MCL1ACMSDENPP3
SCHEMBL25868661 0.93 ABCG2 (0.36) TDP1L3MBTL1MCL1ACMSDENPP3
SCHEMBL25873079 0.93 TDP1 (0.39) TDP1L3MBTL1MCL1ACMSDENPP3
SCHEMBL25871255 0.93 TDP1 (0.39) TDP1L3MBTL1MCL1ACMSDENPP3
SCHEMBL25870976 0.93 ABCG2 (0.34) TDP1L3MBTL1ABCG2ALDH1A1MAPT
SCHEMBL26046050 0.92 TDP1 (0.36) TDP1L3MBTL1MCL1ACMSDENPP3

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-2023132694-A1 ORGANIC LIGHT-EMITTING DEVICE 주식회사 엘지화학 2023-07-13 — — WO disclosed
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