SCHEMBL7933969

SCHEMBL7933969

CC(C)(C)c1cc(C(CCO)C(=O)O)cc(C2(C)CCCCC2)c1O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GLA P06280 1/20 0.37
TSHR P16473 1/20 0.37
ALOX12 P18054 1/20 0.37
NPSR1 Q6W5P4 2/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
ATM Q13315 1/20 0.33
HSD17B10 Q99714 1/20 0.33
RARB P10826 2/20 0.32
RARG P13631 2/20 0.32
PTGDR Q13258 1/20 0.32
PTGDR2 Q9Y5Y4 1/20 0.32
GLRA3 O75311 1/20 0.32
GLRB P48167 1/20 0.32
CACNA1A O00555 1/20 0.31
CACNA2D1 P54289 1/20 0.31
CACNB1 Q02641 1/20 0.31
RARA P10276 1/20 0.31
TP53 P04637 1/20 0.31
GAA P10253 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
SCHEMBL7940459 0.86 RARA (0.33) RARBRARGPTGDRPTGDR2RARA
SCHEMBL8594628 0.85 GLA (0.41) GLATSHRALOX12NPSR1MEN1
SCHEMBL8595049 0.84 GLA (0.43) GLATSHRALOX12NPSR1MEN1
SCHEMBL8401328 0.82 GLRA3 (0.36) GLATSHRALOX12NPSR1MEN1
SCHEMBL7933778 0.80 RARB (0.45) GLATSHRALOX12NPSR1MEN1
SCHEMBL8397549 0.76 TSHR (0.38) GLATSHRALOX12NPSR1MEN1
SCHEMBL8519627 0.76 TSHR (0.39) GLATSHRALOX12NPSR1MEN1
SCHEMBL7933907 0.75 RARB (0.34) GLATSHRALOX12RARBRARG
SCHEMBL7942419 0.74 PTGDR (0.34) GLATSHRALOX12RARBRARG
SCHEMBL7796578 0.74 RARG (0.47) GLATSHRALOX12NPSR1MEN1

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