SCHEMBL8733659

SCHEMBL8733659

CCC(OC)C(C(=O)O)(C(C)C)C1CCCC1

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ACE P12821 1/20 0.31
EPHX1 P07099 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
SCHEMBL8736418 0.80 KEAP1 (0.32) ACE
SCHEMBL8737237 0.79 KEAP1 (0.31) ACE
SCHEMBL8735198 0.74 CCR2 (0.33)
SCHEMBL8428114 0.71
SCHEMBL8428109 0.69
SCHEMBL8737226 0.66 KEAP1 (0.33) ACE
SCHEMBL8733671 0.66 NPSR1 (0.32) ACE
SCHEMBL9468355 0.65 EPHX1 (0.38) EPHX1
SCHEMBL21206335 0.65 EPHX1 (0.34) EPHX1
SCHEMBL14617233 0.65 EPHX2 (0.33) EPHX1

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