SCHEMBL9709245

SCHEMBL9709245

CC/C(C(=O)O)=C(\C(=O)O)C(C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FFAR3 O14843 1/20 0.36
GRIK1 P39086 1/20 0.33
GRIA4 P48058 1/20 0.33
GRIK3 Q13003 1/20 0.33
GRIK5 Q16478 1/20 0.33
TDP1 Q9NUW8 2/20 0.30
ALDH1A1 P00352 1/20 0.30
THRB P10828 1/20 0.30
FNTA P49354 1/20 0.30
FNTB P49356 1/20 0.30
PGGT1B P53609 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
SCHEMBL9720943 1.00 FFAR3 (0.36) FFAR3GRIK1GRIA4GRIK3GRIK5
SCHEMBL9720948 0.81 HDAC3 (0.40) FFAR3TDP1ALDH1A1THRBFNTA
SCHEMBL9709459 0.81 HDAC3 (0.40) FFAR3TDP1ALDH1A1THRBFNTA
SCHEMBL9709237 0.78 FNTA (0.47) TDP1ALDH1A1THRBFNTAFNTB
SCHEMBL9720981 0.78 FNTA (0.47) TDP1ALDH1A1THRBFNTAFNTB
SCHEMBL9720926 0.75 ALDH1A1 (0.37) GRIK1GRIA4GRIK3GRIK5TDP1
SCHEMBL9709335 0.75 ALDH1A1 (0.37) GRIK1GRIA4GRIK3GRIK5TDP1
SCHEMBL3982859 0.74 TSHR (0.41) FFAR3ALDH1A1
SCHEMBL3982854 0.74 TSHR (0.41) FFAR3ALDH1A1
SCHEMBL2935812 0.74 TSHR (0.41) FFAR3ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3022213-B1 PROCESS FOR THE PREPARATION OF ROSUVASTATIN CALCIUM AND PREPARATION OF ITS NOVEL INTERMEDIATES SUVEN LIFE SCIENCES LTD (IN) 2017-06-21 EP claimed
EP-0244835-B1 LANGMUIR-BLODGETT ULTRATHIN MEMBRANE OF POLYFUMURATE NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1992-08-26 EP claimed
EP-0192997-B1 METHOD FOR MODIFYING POLYFUMARIC ACID DIESTER NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1992-04-29 EP claimed