SCHEMBL4453022

SCHEMBL4453022

C=CC/C(C)=C\CC(O)C(=O)N(C)OC

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
FAAH O00519 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
SCHEMBL3089775 1.00 FAAH (0.31) FAAH
SCHEMBL3089772 1.00 FAAH (0.31) FAAH
SCHEMBL3089776 1.00 FAAH (0.31) FAAH
SCHEMBL14226490 0.83
SCHEMBL8282813 0.81
SCHEMBL13093838 0.77 MEN1 (0.33)
SCHEMBL2495856 0.76 FNTA (0.32)
SCHEMBL4058776 0.76 FNTA (0.32)
SCHEMBL2495854 0.76 FNTA (0.32)
SCHEMBL2495853 0.76 FNTA (0.32)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009112077-A1 PROCESS FOR THE PREPARATION OF EPOTHILONE PRECURSOR COMPOUNDS F. HOFFMANN-LA ROCHE AG (CH) 2009-09-17 WO disclosed
WO-2009064800-A1 INTERMEDIATES AND METHODS FOR THE PREPARATION OF EPOTHILONES KOSAN BIOSCIENCES, INC. (US) 2009-05-22 WO disclosed