SCHEMBL7940280

SCHEMBL7940280

Cc1cc(CCC(=O)OCCO)cc(C(C)(C)CC(C)(C)C)c1O

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.39
CYP4F2 P78329 1/20 0.38
CYP4A11 Q02928 1/20 0.38
APP P05067 2/20 0.36
TDP1 Q9NUW8 1/20 0.35
GAA P10253 2/20 0.35
CYP3A4 P08684 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
KMT2A Q03164 2/20 0.33
ALDH1A1 P00352 1/20 0.33
MEN1 O00255 1/20 0.33
CNR2 P34972 1/20 0.32
MGLL Q99685 1/20 0.32
ESR1 P03372 1/20 0.32
MDH1 P40925 1/20 0.31
MDH2 P40926 1/20 0.31
TNKS2 Q9H2K2 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
SCHEMBL8598476 0.89 CYP4F2 (0.42) ALOX5CYP4F2CYP4A11APPTDP1
SCHEMBL7944692 0.89 GAA (0.47) ALOX5APPGAACYP3A4SMN1; SMN2
SCHEMBL31747055 0.88 GAA (0.47) ALOX5CYP4F2CYP4A11APPTDP1
SCHEMBL7796538 0.88 GAA (0.47) ALOX5CYP4F2CYP4A11APPTDP1
SCHEMBL7943346 0.87 ALOX5 (0.38) ALOX5CYP4F2CYP4A11APPTDP1
SCHEMBL7940283 0.86 CNR2 (0.41) ALOX5CYP4F2CYP4A11CNR2MGLL
SCHEMBL7933767 0.86 ALDH1A1 (0.41) ALOX5CYP4F2CYP4A11APPTDP1
SCHEMBL13121602 0.83 CYP4F2 (0.49) ALOX5CYP4F2CYP4A11APPTDP1
SCHEMBL11117268 0.83 GAA (0.45) ALOX5CYP4F2CYP4A11APPTDP1
SCHEMBL7944812 0.83 GAA (0.42) GAACYP3A4SMN1; SMN2KMT2AALDH1A1

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