SCHEMBL24063857

SCHEMBL24063857

Oc1c(O)c(O)c(-c2ccc(-c3c4ccccc4c(-c4ccccc4)c4ccccc34)c3ccccc23)c(O)c1O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HDAC4 P56524 1/20 0.45
▸ HDAC2 Q92769 1/20 0.45
▸ HDAC8 Q9BY41 1/20 0.45
▸ HDAC6 Q9UBN7 1/20 0.45
▸ ALDH1A1 P00352 2/20 0.41
▸ HPGD P15428 2/20 0.41
▸ BCL2L1 Q07817 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ HNF4A P41235 1/20 0.41
▸ MAPT P10636 2/20 0.41
▸ ACHE P22303 2/20 0.39
▸ THRA P10827 1/20 0.39
▸ THRB P10828 1/20 0.39
▸ KMT2A Q03164 3/20 0.39
▸ LMNA P02545 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ PDE4A P27815 2/20 0.38
▸ PDE4B Q07343 2/20 0.38
▸ PDE4C Q08493 2/20 0.38
▸ PDE4D Q08499 2/20 0.38

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
SCHEMBL23341894 0.86 HDAC4 (0.48) HDAC4HDAC2HDAC8HDAC6ALDH1A1
SCHEMBL10017160 0.83 IDO1 (0.54) ALDH1A1HPGDBCL2L1HSD17B10ACHE
SCHEMBL29511656 0.82 ACHE (0.45) ALDH1A1HPGDBCL2L1HSD17B10MAPT
SCHEMBL15128905 0.82 ACHE (0.45) ALDH1A1HPGDBCL2L1HSD17B10MAPT
SCHEMBL24936787 0.81 BCL2L1 (0.46) HDAC4HDAC2HDAC8HDAC6ALDH1A1
SCHEMBL27979829 0.81 HPGD (0.60) HDAC4HDAC2HDAC8HDAC6ALDH1A1
SCHEMBL7918998 0.80 MAPT (0.47) HDAC4HDAC2HDAC8HDAC6ALDH1A1
SCHEMBL23341325 0.78 HDAC4 (0.42) HDAC4HDAC2HDAC8HDAC6ALDH1A1
SCHEMBL25957743 0.78 ACHE (0.45) HDAC4HDAC2HDAC8HDAC6ALDH1A1
SCHEMBL26482166 0.77 MCL1 (0.43) HDAC8HDAC6ALDH1A1HPGDHSD17B10

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
EP-3373353-B1 ORGANIC LIGHT-EMITTING ELEMENT LG CHEMICAL LTD (KR) 2021-12-01 — — EP disclosed
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