SCHEMBL16693102

SCHEMBL16693102

COCC1CCCC2(C1)OC(=O)C(c1ccc(Cl)cc1C)=C2OP(C)(=S)OCC(F)(F)F

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ACACB O00763 1/20 0.32
ACACA Q13085 1/20 0.32

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
SCHEMBL734176 0.89
SCHEMBL15304578 0.87 BACE1 (0.30)
SCHEMBL16556751 0.83
SCHEMBL16168314 0.80
SCHEMBL17012719 0.80
SCHEMBL16693101 0.79 ACACB (0.43) ACACBACACA
SCHEMBL13963576 0.79
SCHEMBL12214977 0.75
SCHEMBL13039863 0.71
SCHEMBL12029775 0.71 PTGS2 (0.33) ACACBACACA

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-1943218-B1 ALKOXYALKYL SPIROCYCLIC TETRAMIC ACIDS AND TETRONIC ACIDS BAYER IP GMBH (DE) 2015-05-06 EP disclosed