SCHEMBL24657367

SCHEMBL24657367

c1ccc2c(-c3ccc(N(c4ccc(-c5ccc6c(ccc7ccc8ccccc8c76)c5)cc4)c4cccc5oc6ccccc6c45)cc3)cccc2c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 2/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ CA12 O43570 2/20 0.36
▸ CA1 P00915 2/20 0.36
▸ CA2 P00918 2/20 0.36
▸ CA9 Q16790 2/20 0.36
▸ ENPP3 O14638 1/20 0.32
▸ ENPP1 P22413 1/20 0.32
▸ HCRTR1 O43613 1/20 0.32
▸ ABCG2 Q9UNQ0 1/20 0.31
▸ HSD17B1 P14061 1/20 0.31
▸ HSD17B2 P37059 1/20 0.31
▸ HDAC8 Q9BY41 1/20 0.31
▸ HDAC6 Q9UBN7 1/20 0.31
▸ CYP1A2 P05177 2/20 0.31
▸ AHR P35869 2/20 0.31
▸ ERBB2 P04626 1/20 0.31
▸ FYN P06241 1/20 0.31
▸ MAOA P21397 1/20 0.31
▸ ACHE P22303 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
SCHEMBL25871262 0.96 TDP1 (0.38) TDP1L3MBTL1CA12CA1CA2
SCHEMBL24657688 0.95 TDP1 (0.37) TDP1L3MBTL1CA12CA1CA2
SCHEMBL24655236 0.94 CA12 (0.37) TDP1L3MBTL1CA12CA1CA2
SCHEMBL24656436 0.94 TDP1 (0.39) TDP1L3MBTL1CA12CA1CA2
SCHEMBL26057106 0.94 CA12 (0.37) TDP1L3MBTL1CA12CA1CA2
SCHEMBL22255667 0.93 CA12 (0.40) TDP1L3MBTL1CA12CA1CA2
SCHEMBL21214856 0.93 CA12 (0.40) TDP1L3MBTL1CA12CA1CA2
SCHEMBL22255350 0.92 CA12 (0.38) TDP1L3MBTL1CA12CA1CA2
SCHEMBL22255557 0.92 CA12 (0.38) TDP1L3MBTL1CA12CA1CA2
SCHEMBL24657461 0.92 TDP1 (0.40) TDP1L3MBTL1HCRTR1ABCG2CYP1A2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4243100-A1 ORGANIC LIGHT-EMITTING DEVICE Lg Chem, Ltd. (KR) 2023-09-13 — — EP disclosed
WO-2022177374-A1 ORGANIC LIGHT-EMITTING DEVICE 주식회사 엘지화학 2022-08-25 — — WO disclosed
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