SCHEMBL7933829

SCHEMBL7933829

Cc1cc(CC(=O)OCCO)cc(C2(C)CCCCC2)c1O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GLA P06280 1/20 0.38
TSHR P16473 1/20 0.38
ALOX12 P18054 1/20 0.38
PTGDR Q13258 1/20 0.36
PTGDR2 Q9Y5Y4 1/20 0.36
ALOX5 P09917 1/20 0.34
KMT2A Q03164 2/20 0.34
NPSR1 Q6W5P4 2/20 0.34
MEN1 O00255 1/20 0.34
ATM Q13315 1/20 0.34
HSD17B10 Q99714 1/20 0.34
CYP19A1 P11511 1/20 0.34
CNR2 P34972 6/20 0.33
ACHE P22303 1/20 0.33
TP53 P04637 1/20 0.32
GAA P10253 1/20 0.32
YWHAG P61981 1/20 0.32
RARB P10826 2/20 0.31
RARG P13631 2/20 0.31
RARA P10276 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
SCHEMBL7943238 0.88 ALOX5 (0.37) GLATSHRALOX12PTGDRPTGDR2
SCHEMBL7933973 0.87 GLA (0.40) GLATSHRALOX12PTGDRPTGDR2
SCHEMBL8397569 0.86 KMT2A (0.41) PTGDRPTGDR2ALOX5KMT2AMEN1
SCHEMBL8400750 0.85 ALDH1A1 (0.34) GLATSHRALOX12PTGDRPTGDR2
SCHEMBL8400868 0.83 YWHAG (0.47) TSHRPTGDRPTGDR2ALOX5CYP19A1
SCHEMBL7786447 0.81 GLA (0.44) GLATSHRALOX12PTGDRPTGDR2
SCHEMBL7940323 0.81 ESR1 (0.47) GLATSHRALOX12PTGDRPTGDR2
SCHEMBL8400745 0.78 KMT2A (0.40) PTGDRPTGDR2ALOX5KMT2AMEN1
SCHEMBL3807177 0.78 GLA (0.46) GLATSHRALOX12PTGDRPTGDR2
SCHEMBL8401559 0.78 RARA (0.47) TSHRPTGDRPTGDR2ALOX5KMT2A

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 1 patent. 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