SCHEMBL172433

SCHEMBL172433

NCC(CN)OCCCC(O)O

nearest known ligand 0.48

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 1/20 0.48

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
SCHEMBL172789 0.77 DNM1 (0.32) DNM1
SCHEMBL172842 0.70 ALDH1A1 (0.38)
SCHEMBL1449501 0.69
SCHEMBL27333085 0.69
SCHEMBL9439439 0.68 TSHR (0.33)
SCHEMBL25046373 0.67 DNM1 (0.95) DNM1
SCHEMBL20040004 0.65 DNM1 (0.63) DNM1
SCHEMBL1052813 0.64
SCHEMBL21119916 0.64 DNM1 (0.61) DNM1
SCHEMBL19194915 0.64 DNM1 (0.32) 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