SCHEMBL7942452

SCHEMBL7942452

CCOc1c(C)cc(CCC(=O)O)cc1C(C)(C)C

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 7/20 0.45
FFAR1 O14842 4/20 0.45
THRB P10828 8/20 0.42
THRA P10827 7/20 0.42
GAA P10253 2/20 0.40
KMT2A Q03164 1/20 0.40
RXRA P19793 1/20 0.40
RXRB P28702 1/20 0.40
RXRG P48443 1/20 0.40
NPSR1 Q6W5P4 1/20 0.39
FFAR2 O15552 1/20 0.39

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
SCHEMBL4009929 0.91 THRB (0.46) FFAR1THRBTHRAGAAKMT2A
SCHEMBL7796449 0.86 THRB (0.55) THRBTHRARXRARXRBRXRG
SCHEMBL7792155 0.86 FFAR1 (0.44) FFAR4FFAR1THRBTHRAGAA
SCHEMBL7940450 0.82 CYP4F2 (0.44) GAAKMT2A
SCHEMBL7933661 0.80 CYP4F2 (0.42) FFAR4FFAR1GAAKMT2A
SCHEMBL6567740 0.80 CYP4F2 (0.37) GAA
SCHEMBL7796603 0.79 GAA (0.45) FFAR1THRBTHRAGAAKMT2A
SCHEMBL29048397 0.79 VCAM1 (0.56) GAAKMT2A
Calcium SCHEMBL10688651 0.78 THRA (0.40) THRBTHRAGAAKMT2ARXRA
SCHEMBL7940376 0.78 CNR2 (0.37)

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 2 patents. 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
US-5914361-A IMPART HEAT STABILITY TO ORGANIC MATERIALS, INCLUDING POLYOLEFINS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-06-22 US disclosed