SCHEMBL8735204

SCHEMBL8735204

CCC(OC)C(CC(C)C)(CC(C)C)C(=O)O

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MMP8 P22894 1/20 0.32
GRM2 Q14416 1/20 0.31
GRM3 Q14832 1/20 0.31
KCNH2 Q12809 1/20 0.31

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
SCHEMBL11328279 0.71 RNPEP (0.34) MMP8GRM2GRM3
SCHEMBL17376817 0.69 ALDH1A1 (0.34) GRM2GRM3
SCHEMBL7436795 0.69 GRM2 (0.31) GRM2GRM3
SCHEMBL7438539 0.69 GRM2 (0.31) GRM2GRM3
SCHEMBL8735217 0.68
SCHEMBL17376799 0.67 SLC1A3 (0.36) GRM2GRM3
SCHEMBL5972496 0.65 CACNA2D1 (0.36) GRM2GRM3
SCHEMBL17376871 0.65 GRM2 (0.33) GRM2GRM3
SCHEMBL1068929 0.64
SCHEMBL21859002 0.64 RNPEP (0.36) GRM2GRM3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0704424-B1 3-Alkoxypropionic ester derivative, olefin polymerization catalyst, and process for preparation of polyolefin SHOWA DENKO KK (JP) 1998-12-30 EP claimed