SCHEMBL4228050

SCHEMBL4228050

CCC(CC)=C(CC)C(=O)O.OCC(CO)(CO)CO

nearest known ligand 0.44

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 1/20 0.44
GRIA4 P48058 1/20 0.44
GRIK3 Q13003 1/20 0.44
GRIK5 Q16478 1/20 0.44
FFAR3 O14843 1/20 0.33

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
SCHEMBL28704657 0.91 GRIK1 (0.41) GRIK1GRIA4GRIK3GRIK5FFAR3
SCHEMBL7755782 0.85 GRIK1 (0.54) GRIK1GRIA4GRIK3GRIK5FFAR3
Propionic Acid SCHEMBL8342622 0.75 FFAR3 (0.62) FFAR3
Propionic Acid SCHEMBL8927677 0.75 FFAR3 (0.62) FFAR3
Propionic Acid SCHEMBL235022 0.75 FFAR3 (0.62) FFAR3
Propionic Acid SCHEMBL1326488 0.75 FFAR3 (0.62) FFAR3
Propionic Acid SCHEMBL259572 0.75 FFAR3 (0.62) FFAR3
SCHEMBL324024 0.74 GRIK1 (0.35) GRIK1FFAR3
SCHEMBL31016191 0.74
SCHEMBL4091544 0.71 FFAR3 (0.43) GRIK1GRIA4GRIK3GRIK5FFAR3

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-8394504-B2 Optical planar thermoplastic resin composition NIPPON SHOKUBAI CO., LTD. (JP) 2013-03-12 US disclosed
US-20090137743-A1 Optical Planar Thermoplastic Resin Composition NIPPON SHOKUBAI CO., LTD. (JP) 2009-05-28 US disclosed