SCHEMBL7792671

SCHEMBL7792671

COc1ccc(CCC(=O)O)cc1C(C)(C)CC(C)(C)C

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 8/20 0.47
FFAR4 Q5NUL3 6/20 0.47
PPARA Q07869 3/20 0.46
FFAR2 O15552 1/20 0.46
PPARD Q03181 1/20 0.46
FABP4 P15090 1/20 0.45
S1PR1 P21453 1/20 0.44
S1PR5 Q9H228 1/20 0.44
PPARG P37231 1/20 0.42
NR3C1 P04150 2/20 0.42
PLA2G4A P47712 1/20 0.42
ALOX5 P09917 1/20 0.42
OR51E2 Q9H255 1/20 0.42
RXRA P19793 1/20 0.42
RXRB P28702 1/20 0.42
RXRG P48443 1/20 0.42

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
SCHEMBL7794917 0.88 FFAR1 (0.48) FFAR1FFAR4PPARAFFAR2PPARD
SCHEMBL7794931 0.86 GAA (0.57) FABP4NR3C1
SCHEMBL7792665 0.86 FFAR1 (0.51) FFAR1FFAR4PPARAFFAR2PPARD
SCHEMBL7792674 0.85 LTA4H (0.47) FFAR1FFAR4PPARAFFAR2PPARD
SCHEMBL6567361 0.83 NR3C1 (0.44) NR3C1
SCHEMBL7942316 0.83 ALOX5 (0.43) NR3C1ALOX5OR51E2
SCHEMBL6567742 0.82 TNKS2 (0.45) NR3C1ALOX5
SCHEMBL3493151 0.82 S1PR1 (0.59) FFAR1FFAR4PPARAFFAR2PPARD
SCHEMBL7786552 0.82 RXRA (0.44) FFAR1FFAR4ALOX5OR51E2RXRA
SCHEMBL16516853 0.78 FFAR1 (0.50) FFAR1FFAR4PPARAFFAR2PPARD

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 4 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
EP-0823435-A2 Phosphites, process for producing the same and their use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1998-02-11 EP disclosed