SCHEMBL6060893

SCHEMBL6060893

CC(=O)OC1CCCC1(C(=O)O)C1(CC(C)C)CCCCC1

nearest known ligand 0.31

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.31
ALDH1A1 P00352 1/20 0.31
CYP3A4 P08684 1/20 0.31
MAPT P10636 1/20 0.31
ALOX15 P16050 1/20 0.31
ACHE P22303 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
SCHEMBL6060773 0.85
SCHEMBL6060392 0.82 SCN1A (0.40)
SCHEMBL6060434 0.77 CYP3A4 (0.34) USP2CYP3A4ACHE
SCHEMBL6060024 0.76 CYP3A4 (0.35) USP2CYP3A4ACHE
SCHEMBL5651667 0.75 SLC1A2 (0.30)
SCHEMBL4808224 0.70 KDM4E (0.30) ALDH1A1CYP3A4MAPT
SCHEMBL6060771 0.69
SCHEMBL6061238 0.69
SCHEMBL4813800 0.68 RAB9A (0.33)
SCHEMBL1870888 0.68

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
WO-2006045246-A1 CYCLOPENTANE CARBOXYLATE COMPOUNDS, PROCESS AND INTERMEDIATES FOR PREPARING THE SAME AND USE THEREOF CHINA PETROLEUM & CHEMICAL CORPORATION (CN) 2006-05-04 WO disclosed