SCHEMBL7941362

SCHEMBL7941362

Cc1cc(CCC(=O)OCCCCO)cc(C(C)(C)C)c1O

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GAA P10253 4/20 0.44
VCAM1 P19320 3/20 0.42
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.40
ALOX5 P09917 1/20 0.39
CYP4F2 P78329 1/20 0.39
CYP4A11 Q02928 1/20 0.39
CYP1A2 P05177 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
APP P05067 1/20 0.37
PKM P14618 1/20 0.37
HTT P42858 1/20 0.37
TNKS2 Q9H2K2 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
ESR1 P03372 1/20 0.36

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
SCHEMBL11117268 0.96 GAA (0.45) GAAVCAM1KMT2AMEN1ALOX5
SCHEMBL7941216 0.94 VCAM1 (0.44) GAAVCAM1KMT2AMEN1CYP1A2
SCHEMBL106874 0.94 GAA (0.47) GAAKMT2AMEN1ALOX5CYP1A2
SCHEMBL3251294 0.94 GAA (0.47) GAAKMT2AMEN1ALOX5CYP1A2
SCHEMBL20390735 0.93 GAA (0.49) GAAVCAM1KMT2AMEN1ALOX5
SCHEMBL22991673 0.93 GAA (0.49) GAAVCAM1KMT2AMEN1ALOX5
SCHEMBL4268981 0.92 GAA (0.51) GAAVCAM1KMT2AMEN1ALOX5
SCHEMBL20695593 0.91 GAA (0.50) GAAVCAM1KMT2AMEN1ALOX5
SCHEMBL27614591 0.91 GAA (0.50) GAAVCAM1KMT2AMEN1ALOX5
SCHEMBL7796538 0.91 GAA (0.47) GAAVCAM1KMT2AMEN1ALOX5

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
US-6242514-B1 CYCLIC PHOSPHATE OR PHOSPHONATE; HEAT AND OXIDATION STABILIZER ESPECIALLY FOR OLEFIN POLYMERS AND ENGINEERING THERMOPLASTICS SUMITOMO CHEMICAL COMPANY, LTD. (JP) 2001-06-05 US disclosed
US-5914361-A IMPART HEAT STABILITY TO ORGANIC MATERIALS, INCLUDING POLYOLEFINS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-06-22 US disclosed
EP-0861847-A2 Stabilizer composition and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1998-09-02 EP disclosed