SCHEMBL7940461

SCHEMBL7940461

CCC(O)(C(=O)O)c1cc(C(C)(C)C)c(OC)c(C2(C)CCCCC2)c1

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
RARG P13631 5/20 0.34
RARB P10826 3/20 0.34
RARA P10276 2/20 0.34
PTGDR Q13258 1/20 0.34
PTGDR2 Q9Y5Y4 1/20 0.34
ADORA3 P0DMS8 1/20 0.33
RXRA P19793 2/20 0.32
PPARG P37231 2/20 0.32
TNFRSF1A P19438 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
SCHEMBL7933908 0.87 PTGDR (0.36) RARGRARBRARAPTGDRPTGDR2
SCHEMBL7942422 0.86 PTGDR (0.36) RARGRARBRARAPTGDRPTGDR2
SCHEMBL7933971 0.85 TSHR (0.36) RARGRARBRARAPTGDRPTGDR2
SCHEMBL7940452 0.78 PTGDR (0.41) RARGRARBRARAPTGDRPTGDR2
SCHEMBL7933933 0.78 RARB (0.51) RARGRARBRARAPTGDRPTGDR2
SCHEMBL8400788 0.76 RARB (0.35) RARGRARBRARAPTGDRPTGDR2
SCHEMBL7942372 0.76 CYP26B1 (0.39) RARGRARBRARAPTGDRPTGDR2
SCHEMBL8594630 0.76 GLA (0.41) RARGRARBRARAPTGDRPTGDR2
SCHEMBL8519229 0.75
SCHEMBL8595052 0.75 GLA (0.43) RARGRARBRARAPTGDRPTGDR2

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