SCHEMBL27797903

SCHEMBL27797903

CCC(=O)OCC(O)c1cccc(C(C)(C)C)c1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 3/20 0.39
▸ PNMT P11086 1/20 0.39
▸ BCHE P06276 4/20 0.37
▸ GRIN2B Q13224 1/20 0.36
▸ HDAC4 P56524 1/20 0.36
▸ HDAC2 Q92769 1/20 0.36
▸ HDAC8 Q9BY41 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ RXRA P19793 1/20 0.35
▸ RXRB P28702 1/20 0.35
▸ BACE1 P56817 2/20 0.35
▸ CTSA P10619 1/20 0.35

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
SCHEMBL27796405 0.80 GAA (0.41) L3MBTL1CTSA
SCHEMBL4352840 0.79 LMNA (0.52) L3MBTL1
SCHEMBL6055132 0.77 LMNA (0.53) ACHEPNMTBCHEGRIN2BHDAC4
SCHEMBL16672741 0.76 ACHE (0.40) ACHEPNMTBCHEHDAC4HDAC2
SCHEMBL5871219 0.75 PNMT (0.42) ACHEPNMTBCHEGRIN2BHDAC4
SCHEMBL6055382 0.74 PNMT (0.46) ACHEPNMTBCHEGRIN2BHDAC4
SCHEMBL29256494 0.74 PNMT (0.49) ACHEPNMTBCHEGRIN2BHDAC4
SCHEMBL30988789 0.74 PNMT (0.49) ACHEPNMTBCHEGRIN2BHDAC4
SCHEMBL6055345 0.73 PNMT (0.45) ACHEPNMTBCHEGRIN2BHDAC4
SCHEMBL7146806 0.72 PNMT (0.70) ACHEPNMTBCHEGRIN2BHDAC4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101616982-B Chlorinated rubber composition and hose YOKOHAMA RUBBER CO LTD 2012-11-14 — — CN claimed
CN-101616982-A Chlorinated rubber composition and flexible pipe YOKOHAMA RUBBER CO LTD 2009-12-30 — — CN claimed
CN-101616982-B Chlorinated rubber composition and hose YOKOHAMA RUBBER CO LTD 2012-11-14 — — CN disclosed
CN-101616982-A Chlorinated rubber composition and flexible pipe YOKOHAMA RUBBER CO LTD 2009-12-30 — — CN disclosed
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