SCHEMBL2666658

SCHEMBL2666658

CCO[C@@H]1CC[C@@H](OC)C1

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL10042827 1.00 ALDH1A1 (0.31) ALDH1A1SMN1; SMN2
SCHEMBL19661707 0.86
SCHEMBL18361629 0.83 ALDH1A1 (0.33) ALDH1A1SMN1; SMN2
SCHEMBL5477828 0.83
SCHEMBL28243810 0.80 ALDH1A1 (0.38) ALDH1A1SMN1; SMN2
SCHEMBL14341674 0.80 ALDH1A1 (0.38) ALDH1A1SMN1; SMN2
SCHEMBL18699662 0.80
SCHEMBL21663399 0.80
SCHEMBL16404858 0.77 HSD11B1 (0.32) ALDH1A1SMN1; SMN2
SCHEMBL184319 0.76

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-2007007886-A1 AN OXIME DERIVATIVE AND PREPARATIONS THEREOF MITSUBISHI TANABE PHARMA CORPORATION (JP) 2007-01-18 WO disclosed