SCHEMBL9340568

SCHEMBL9340568

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

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 6/20 0.38
KMT2A Q03164 4/20 0.38
ALDH1A1 P00352 3/20 0.33
MEN1 O00255 3/20 0.33
LMNA P02545 2/20 0.33
HTT P42858 2/20 0.32
AGTR1 P30556 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
PKM P14618 1/20 0.32
HMGCR P04035 1/20 0.32
USP2 O75604 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2D6 P10635 1/20 0.31
MAPT P10636 1/20 0.31
TSHR P16473 1/20 0.31
MAPK1 P28482 1/20 0.31
BLM P54132 1/20 0.31
ATM Q13315 1/20 0.31
HIF1A Q16665 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
SCHEMBL9345240 0.94 GAA (0.33) GAAKMT2AALDH1A1MEN1LMNA
SCHEMBL9340570 0.86 GAA (0.47) GAAKMT2AALDH1A1MEN1LMNA
SCHEMBL132812 0.84 GAA (0.51) GAAKMT2AALDH1A1MEN1LMNA
SCHEMBL9342618 0.80 GAA (0.48) GAAKMT2AALDH1A1MEN1LMNA
SCHEMBL9345249 0.80 GAA (0.41) GAAKMT2AALDH1A1MEN1LMNA
SCHEMBL5176136 0.79 GAA (0.51) GAAKMT2AALDH1A1MEN1LMNA
SCHEMBL24503462 0.78 GAA (0.49) GAAKMT2AALDH1A1MEN1LMNA
SCHEMBL10618601 0.78 HSPA5 (0.45) GAAKMT2AALDH1A1MEN1LMNA
SCHEMBL10618619 0.77 GAA (0.44) GAAKMT2AALDH1A1MEN1LMNA
SCHEMBL22675716 0.77 GAA (0.47) GAAKMT2AALDH1A1MEN1LMNA

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