SCHEMBL8612839

SCHEMBL8612839

CC(C)c1cc(OO)c(OO)c(C(C)C)c1C(C)C

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31

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
SCHEMBL29494156 0.76 CA1 (0.34) CA1CA2
SCHEMBL99127 0.76 CA1 (0.34) CA1CA2
SCHEMBL7983115 0.74 CA1 (0.33) CA1CA2
SCHEMBL3271576 0.74 CA1 (0.36) CA1CA2
SCHEMBL1877670 0.72 CA1 (0.34) CA1CA2
SCHEMBL9644439 0.72 BACE1 (0.34)
SCHEMBL11574289 0.68 LMNA (0.33) CA1CA2
SCHEMBL10893505 0.68
SCHEMBL4634575 0.67 CA1 (0.39) CA1CA2
SCHEMBL3271549 0.67

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0622350-B1 PROCESS FOR PRODUCING AROMATIC HYDROXYLIC COMPOUND MITSUI PETROCHEMICAL IND (JP) 1998-04-15 EP claimed
US-5475157-A Decomposing a hydroperoxide in the presence of an acid catalyst; by-product inhibition MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1995-12-12 US claimed
EP-0622350-A1 PROCESS FOR PRODUCING AROMATIC HYDROXYLIC COMPOUND MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1994-11-02 EP claimed
EP-0622350-B1 PROCESS FOR PRODUCING AROMATIC HYDROXYLIC COMPOUND MITSUI PETROCHEMICAL IND (JP) 1998-04-15 EP disclosed
US-5475157-A Decomposing a hydroperoxide in the presence of an acid catalyst; by-product inhibition MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1995-12-12 US disclosed
EP-0622350-A1 PROCESS FOR PRODUCING AROMATIC HYDROXYLIC COMPOUND MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1994-11-02 EP disclosed