SCHEMBL7944812

SCHEMBL7944812

Cc1cc(CCCC(=O)OCCO)cc(C(C)(C)C)c1O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 4/20 0.42
VCAM1 P19320 4/20 0.41
KMT2A Q03164 3/20 0.40
CYP1A2 P05177 2/20 0.39
CYP2C9 P11712 2/20 0.39
CYP2C19 P33261 2/20 0.39
MEN1 O00255 2/20 0.39
CNR2 P34972 1/20 0.38
HTT P42858 2/20 0.37
PKM P14618 1/20 0.37
ALDH1A1 P00352 2/20 0.36
MAPK1 P28482 2/20 0.36
GSR P00390 2/20 0.36
KDM4E B2RXH2 1/20 0.36
MAPT P10636 1/20 0.36
HPGD P15428 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
MGLL Q99685 1/20 0.36
SCN2A Q99250 1/20 0.36
GMNN O75496 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
SCHEMBL2954203 0.95 CNR2 (0.43) GAAVCAM1KMT2ACYP1A2CYP2C9
SCHEMBL7941324 0.94 VCAM1 (0.43) GAAVCAM1KMT2ACYP1A2CYP2C9
SCHEMBL7941216 0.93 VCAM1 (0.44) GAAVCAM1KMT2ACYP1A2CYP2C9
SCHEMBL7796538 0.92 GAA (0.47) GAAVCAM1KMT2ACYP1A2CYP2C9
SCHEMBL31747055 0.92 GAA (0.47) GAAVCAM1KMT2ACYP1A2CYP2C9
SCHEMBL7933616 0.92 GAA (0.49) GAAVCAM1KMT2ACYP1A2CYP2C9
SCHEMBL29735971 0.91 GAA (0.43) GAAVCAM1KMT2ACYP1A2CYP2C9
SCHEMBL29559065 0.91 GAA (0.43) GAAVCAM1KMT2ACYP1A2CYP2C9
SCHEMBL11613837 0.90 CNR2 (0.41) GAAVCAM1KMT2ACYP1A2CYP2C9
SCHEMBL10866975 0.89 GAA (0.43) GAAVCAM1KMT2ACYP1A2CYP2C9

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