SCHEMBL7794887

SCHEMBL7794887

COc1c(C)cc(CC(=O)O)cc1C1(C)CCCCC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGDR Q13258 1/20 0.43
PTGDR2 Q9Y5Y4 1/20 0.43
RXRA P19793 1/20 0.40
RXRB P28702 1/20 0.40
RXRG P48443 1/20 0.40
THRB P10828 4/20 0.39
THRA P10827 3/20 0.39
RARB P10826 3/20 0.38
RARG P13631 3/20 0.38
RARA P10276 2/20 0.38
CYP26A1 O43174 4/20 0.36
CYP26B1 Q9NR63 2/20 0.36
ALDH1A1 P00352 2/20 0.35
GAA P10253 2/20 0.35
TSHR P16473 2/20 0.35
PTGS1 P23219 1/20 0.35
AKR1C3 P42330 1/20 0.35
AKR1C2 P52895 1/20 0.35
NFKB1 P19838 1/20 0.35
TDP1 Q9NUW8 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
SCHEMBL7794944 0.87 THRA (0.41) PTGDRPTGDR2RXRATHRBTHRA
SCHEMBL7792167 0.86 PTGDR (0.43) PTGDRPTGDR2RXRARXRBRXRG
SCHEMBL7940452 0.84 PTGDR (0.41) PTGDRPTGDR2RXRARXRBRXRG
SCHEMBL8397569 0.83 KMT2A (0.41) PTGDRPTGDR2RARBRARGRARA
SCHEMBL7786447 0.82 GLA (0.44) PTGDRPTGDR2RXRARXRBRXRG
SCHEMBL6567296 0.81 GLA (0.35) PTGDRPTGDR2RARBRARGRARA
SCHEMBL7794974 0.80 RARB (0.49) PTGDRPTGDR2RXRARXRBRXRG
SCHEMBL287411 0.80 THRB (0.49) RXRATHRBTHRAALDH1A1GAA
SCHEMBL7944933 0.79 TNKS2 (0.38) PTGDRPTGDR2RARBRARGRARA
SCHEMBL7786595 0.77 RARA (0.55) PTGDRPTGDR2RXRARXRBRXRG

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0823435-B1 Phosphites, process for producing the same and their use SUMITOMO CHEMICAL CO (JP) 2001-11-21 EP disclosed
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
US-5889095-A OXYGEN AND HEAT RESISTANCE SUMITOMO CHEMICAL COMPANY, LTD. (JP) 1999-03-30 US disclosed
EP-0823435-A2 Phosphites, process for producing the same and their use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1998-02-11 EP disclosed