SCHEMBL9345240

SCHEMBL9345240

CCC(=O)OC(c1cc(C)c(O)c(C(C)(C)C)c1)C(COC(=O)CCc1cc(C)c(O)c(C(C)(C)C)c1)OCC(COC(=O)CCc1cc(C)c(O)c(C(C)(C)C)c1)OC(=O)CCc1cc(C)c(O)c(C(C)(C)C)c1

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.33
KMT2A Q03164 2/20 0.33
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
PKM P14618 1/20 0.30
HTT P42858 1/20 0.30

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
SCHEMBL9340568 0.94 GAA (0.38) GAAKMT2AMEN1ALDH1A1LMNA
SCHEMBL9345249 0.86 GAA (0.41) GAAKMT2AMEN1ALDH1A1LMNA
SCHEMBL10618619 0.84 GAA (0.44) GAAKMT2AMEN1ALDH1A1LMNA
SCHEMBL9342605 0.81 GAA (0.41) GAAKMT2AMEN1ALDH1A1LMNA
SCHEMBL10915912 0.80 GAA (0.44) GAAKMT2AMEN1ALDH1A1LMNA
SCHEMBL10915909 0.80 GAA (0.44) GAAKMT2AMEN1ALDH1A1LMNA
SCHEMBL9340570 0.80 GAA (0.47) GAAKMT2AMEN1ALDH1A1LMNA
SCHEMBL132812 0.78 GAA (0.51) GAAKMT2AMEN1ALDH1A1LMNA
SCHEMBL11019958 0.77 GAA (0.41) GAAKMT2AMEN1ALDH1A1LMNA
SCHEMBL11017700 0.77 GAA (0.41) GAAKMT2AMEN1ALDH1A1LMNA

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-0421928-B1 Hydroxyphenylcarboxylic acid esters as stabilizers CIBA GEIGY AG (CH) 1994-06-15 EP disclosed
US-5177246-A Hydroxphenylcarboxylic acid esters as stabilizers CIBA-GEIGY CORPORATION (US) 1993-01-05 US disclosed
EP-0421928-A2 Hydroxyphenylcarboxylic acid esters as stabilizers CIBA-GEIGY AG (CH) 1991-04-10 EP disclosed