SCHEMBL6060486

SCHEMBL6060486

CCCC1(C(=O)O)CCCC1OC(C)=O

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
EP300 Q09472 1/20 0.33
HIF1A Q16665 1/20 0.33
CREBBP Q92793 1/20 0.33
ACHE P22303 1/20 0.32
CYP3A4 P08684 1/20 0.31
PTGES O14684 1/20 0.31
AKT1 P31749 10/20 0.31
HSD11B1 P28845 1/20 0.31
HSD11B2 P80365 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
SCHEMBL5072440 0.91 AKT1 (0.36) AKT1
SCHEMBL6060516 0.90 AKT1 (0.40) AKT1
SCHEMBL6061003 0.88 AKT1 (0.42) AKT1
SCHEMBL6060420 0.88 AKT1 (0.42) AKT1
SCHEMBL6060835 0.87 CYP3A4 (0.33) EP300HIF1ACREBBPACHECYP3A4
SCHEMBL4808452 0.86 AKT1 (0.35) ACHECYP3A4AKT1
SCHEMBL4810499 0.84 AKT1 (0.45) ACHEAKT1
SCHEMBL6060991 0.81 HSD11B1 (0.37) HSD11B1
SCHEMBL4814404 0.80 AKT1 (0.36) AKT1
SCHEMBL6060493 0.79 HSD11B1 (0.36) AKT1HSD11B1

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