SCHEMBL6061003

SCHEMBL6061003

CCCCCCC1(C(=O)O)CCCC1OC(C)=O

nearest known ligand 0.45

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 10/20 0.42
NAAA Q02083 2/20 0.37

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
SCHEMBL6060420 1.00 AKT1 (0.42) AKT1NAAA
SCHEMBL6060516 0.99 AKT1 (0.40) AKT1NAAA
SCHEMBL5072440 0.94 AKT1 (0.36) AKT1NAAA
SCHEMBL6060486 0.88 EP300 (0.33) AKT1
SCHEMBL4810968 0.88 AKT1 (0.46) AKT1NAAA
SCHEMBL4814367 0.86 AKT1 (0.44) AKT1NAAA
SCHEMBL4805845 0.85 AKT1 (0.57) AKT1NAAA
SCHEMBL6060493 0.85 HSD11B1 (0.36) AKT1
SCHEMBL6060749 0.85 HSD11B1 (0.36) AKT1
SCHEMBL4806422 0.84 AKT1 (0.55) AKT1NAAA

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