SCHEMBL28061029

SCHEMBL28061029

COC(=O)OC(=O)C=Cc1ccc(OC)cc1C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.49
▸ ALDH1A1 P00352 2/20 0.49
▸ MEN1 O00255 2/20 0.49
▸ KMT2A Q03164 2/20 0.49
▸ LY96 Q9Y6Y9 1/20 0.46
▸ JUN P05412 1/20 0.46
▸ NFKB1 P19838 1/20 0.46
▸ TNFRSF1A P19438 1/20 0.45
▸ TDP1 Q9NUW8 1/20 0.44
▸ HDAC8 Q9BY41 3/20 0.43
▸ NPC1 O15118 2/20 0.43
▸ RAB9A P51151 2/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ ABCG2 Q9UNQ0 1/20 0.43
▸ BACE1 P56817 1/20 0.42
▸ HDAC3 O15379 1/20 0.42
▸ HDAC1 Q13547 1/20 0.42
▸ MAPK1 P28482 1/20 0.42
▸ MAOB P27338 1/20 0.42
▸ GABRA3 P34903 1/20 0.42

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
SCHEMBL3896958 0.88 MAPT (0.54) MAPTALDH1A1MEN1KMT2ALY96
SCHEMBL3896955 0.88 MAPT (0.54) MAPTALDH1A1MEN1KMT2ALY96
SCHEMBL3719964 0.80 MAPT (0.55) MAPTALDH1A1MEN1KMT2ALY96
SCHEMBL3785272 0.80 THRB (0.57) MAPTALDH1A1MEN1KMT2ALY96
SCHEMBL3719966 0.80 MAPT (0.55) MAPTALDH1A1MEN1KMT2ALY96
SCHEMBL3785276 0.80 THRB (0.57) MAPTALDH1A1MEN1KMT2ALY96
SCHEMBL27463292 0.80 APP (0.52) MAPTALDH1A1MEN1KMT2ATDP1
SCHEMBL28368058 0.80 APP (0.52) MAPTALDH1A1MEN1KMT2ATDP1
SCHEMBL18538458 0.79 HDAC8 (0.65) LY96HDAC8HDAC3HDAC1
SCHEMBL20227828 0.79 MAPT (0.54) MAPTALDH1A1MEN1KMT2ALY96

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
CN-104262678-B Additive for polymer HUANG XIURU (CN) 2016-06-01 — — CN disclosed
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