SCHEMBL8440487

SCHEMBL8440487

CONC(=O)/C=C/c1ccc(OC)c(CC=C(C)C)c1OCc1ccc(OC)cc1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ HDAC8 Q9BY41 6/20 0.51
▸ ABCB1 P08183 2/20 0.46
▸ PTPN1 P18031 2/20 0.42
▸ TNFRSF1A P19438 1/20 0.42
▸ ALOX5 P09917 1/20 0.42
▸ LY96 Q9Y6Y9 1/20 0.41
▸ APP P05067 1/20 0.41
▸ MAPT P10636 2/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ MAOB P27338 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ AKR1C4 P17516 1/20 0.39
▸ AKR1C3 P42330 1/20 0.39
▸ AKR1C2 P52895 1/20 0.39

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
SCHEMBL8444865 0.92 ABCB1 (0.43) HDAC8ABCB1PTPN1TNFRSF1AALOX5
SCHEMBL30039059 0.91 HDAC8 (0.62) HDAC8ABCB1PTPN1TNFRSF1AMAPT
SCHEMBL7775518 0.91 HDAC8 (0.62) HDAC8ABCB1PTPN1TNFRSF1AMAPT
SCHEMBL20029756 0.91 HDAC8 (0.52) HDAC8ABCB1PTPN1TNFRSF1AALOX5
SCHEMBL7776748 0.91 HDAC8 (0.62) HDAC8ABCB1PTPN1TNFRSF1AMAPT
SCHEMBL8444371 0.91 ABCB1 (0.42) HDAC8ABCB1PTPN1TNFRSF1AALOX5
SCHEMBL2337927 0.88 AKR1C3 (0.48) HDAC8ABCB1PTPN1TNFRSF1AALOX5
SCHEMBL2337919 0.88 AKR1C3 (0.48) HDAC8ABCB1PTPN1TNFRSF1AALOX5
SCHEMBL7776254 0.86 HDAC1 (0.51) HDAC8
SCHEMBL7776246 0.86 HDAC1 (0.51) HDAC8

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-2277387-A1 New use of histone deacetylase inhibitors in changing MRJP3 protein in royal jelly NatureWise Biotech & Medicals Corporation (TW) 2011-01-26 — — EP disclosed
EP-2236503-A1 Cinamic compounds and derivatives therefrom for the inhibition of histone deacetylase NatureWise Biotech & Medicals Corporation (TW) 2010-10-06 — — EP disclosed
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