SCHEMBL7794944

SCHEMBL7794944

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

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
THRA P10827 4/20 0.41
THRB P10828 4/20 0.41
CYP26B1 Q9NR63 3/20 0.41
CYP26A1 O43174 2/20 0.41
PTGDR Q13258 1/20 0.39
PTGDR2 Q9Y5Y4 1/20 0.39
RARA P10276 2/20 0.39
RARB P10826 2/20 0.39
RARG P13631 2/20 0.39
S1PR1 P21453 4/20 0.38
FFAR4 Q5NUL3 3/20 0.37
FFAR1 O14842 2/20 0.37
RXRA P19793 1/20 0.37
S1PR3 Q99500 2/20 0.37
NPSR1 Q6W5P4 1/20 0.36
CYP3A4 P08684 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
SCHEMBL7794887 0.87 PTGDR (0.43) THRATHRBCYP26B1CYP26A1PTGDR
SCHEMBL7796429 0.86 CYP26B1 (0.41) THRATHRBCYP26B1CYP26A1PTGDR
SCHEMBL7942372 0.84 CYP26B1 (0.39) THRATHRBCYP26B1CYP26A1PTGDR
SCHEMBL6567296 0.84 GLA (0.35) PTGDRPTGDR2RARARARBRARG
SCHEMBL7933878 0.84 ALDH1A1 (0.40) RARARARBRARGS1PR1S1PR3
SCHEMBL7796455 0.83 CYP26B1 (0.44) THRATHRBCYP26B1CYP26A1PTGDR
SCHEMBL7944933 0.82 TNKS2 (0.38) PTGDRPTGDR2RARARARBRARG
SCHEMBL3669296 0.81 NPSR1 (0.52) THRATHRBFFAR4FFAR1NPSR1
SCHEMBL7796541 0.79 RARA (0.53) CYP26B1CYP26A1PTGDRPTGDR2RARA
SCHEMBL7794974 0.78 RARB (0.49) PTGDRPTGDR2RARARARBRARG

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