SCHEMBL172789

SCHEMBL172789

CC(CN)OCCCC(O)O

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 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
SCHEMBL172433 0.77 DNM1 (0.48) DNM1
SCHEMBL27642301 0.77
SCHEMBL172842 0.77 ALDH1A1 (0.38)
SCHEMBL10943226 0.75
SCHEMBL28853140 0.73
SCHEMBL11654487 0.73 DNM1 (0.59) DNM1
SCHEMBL6977413 0.72
SCHEMBL7592695 0.72
SCHEMBL8399166 0.71 DNM1 (0.63) DNM1
SCHEMBL6872756 0.71 DNM1 (0.63) DNM1

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-1979331-B1 TRISUBSTITUTED AMINE COMPOUNDS AS INHIBITORS OF -CHOLESTERYL ESTER TRANSFER PROTEIN CETP MITSUBISHI TANABE PHARMA CORP (JP) 2012-03-07 EP disclosed