SCHEMBL23341894

SCHEMBL23341894

Oc1c(O)c(O)c(-c2c3ccccc3c(-c3ccc(-c4ccccc4)c4ccccc34)c3ccccc23)c(O)c1O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HDAC4 P56524 1/20 0.48
▸ HDAC2 Q92769 1/20 0.48
▸ HDAC8 Q9BY41 1/20 0.48
▸ HDAC6 Q9UBN7 1/20 0.48
▸ ALDH1A1 P00352 4/20 0.45
▸ HPGD P15428 2/20 0.45
▸ HSD17B10 Q99714 2/20 0.45
▸ BCL2L1 Q07817 1/20 0.45
▸ HNF4A P41235 1/20 0.44
▸ BACE1 P56817 1/20 0.41
▸ ALOX5 P09917 1/20 0.41
▸ MAPT P10636 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ PDCD1 Q15116 1/20 0.40
▸ CD274 Q9NZQ7 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ MPI P34949 1/20 0.40
▸ GPR84 Q9NQS5 1/20 0.39
▸ ESR2 Q92731 1/20 0.37

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
SCHEMBL23341325 0.88 HDAC4 (0.42) HDAC4HDAC2HDAC8HDAC6ALDH1A1
SCHEMBL24063857 0.86 HDAC4 (0.45) HDAC4HDAC2HDAC8HDAC6ALDH1A1
SCHEMBL23894715 0.83 ESR2 (0.39) HDAC4HDAC2HDAC8HDAC6ALDH1A1
SCHEMBL15128905 0.81 ACHE (0.45) ALDH1A1HPGDHSD17B10BCL2L1BACE1
SCHEMBL29511656 0.81 ACHE (0.45) ALDH1A1HPGDHSD17B10BCL2L1BACE1
SCHEMBL24936787 0.79 BCL2L1 (0.46) HDAC4HDAC2HDAC8HDAC6ALDH1A1
SCHEMBL20247132 0.78 CYP1A2 (0.39) ALDH1A1HPGDHSD17B10MAPTKMT2A
SCHEMBL261327 0.78 ALDH1A1 (0.44) HDAC4HDAC2HDAC8HDAC6ALDH1A1
SCHEMBL24465446 0.78 CDC14B (0.49) HDAC4HDAC2HDAC8HDAC6ALDH1A1
SCHEMBL26263189 0.78 TNF (0.52) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3889236-B1 ORGANIC LIGHT-EMITTING ELEMENT USING POLYCYCLIC AROMATIC DERIVATIVE COMPOUND SFC CO LTD (KR) 2023-11-22 — — EP disclosed
EP-3750971-B1 ORGANIC ELECTROLUMINESCENT DEVICE SFC CO LTD (KR) 2023-02-22 — — EP disclosed
EP-3660024-B1 POLYCYCLIC AROMATIC COMPOUNDS AND ORGANIC ELECTROLUMINESCENT DEVICES USING THE SAME SFC CO LTD (KR) 2021-05-05 — — EP disclosed
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