SCHEMBL15501155

SCHEMBL15501155

C=C(C)[C@@H]1CC[C@@H](C)C[C@H]1ON

nearest known ligand 0.34

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 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
SCHEMBL17614057 1.00 EPHX1 (0.32) EPHX1
SCHEMBL18919844 0.85
SCHEMBL25145414 0.83
SCHEMBL21537249 0.79
SCHEMBL12604928 0.79 EPHX1 (0.37) EPHX1
SCHEMBL560313 0.79 CHRM2 (0.38) EPHX1
SCHEMBL560314 0.79 CHRM2 (0.38) EPHX1
SCHEMBL3506090 0.77 EPHX1 (0.32) EPHX1
SCHEMBL14389200 0.77 EPHX1 (0.32) EPHX1
SCHEMBL20104219 0.75 CES2 (0.35) EPHX1

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-2706054-A1 Method for the preparation of menthone from isopulegol BASF SE (DE) 2014-03-12 EP disclosed