SCHEMBL21610883

SCHEMBL21610883

CC(C)(CCCN)OCCC(C)(C)OCCOCCCN

nearest known ligand 0.46

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ODC1 P11926 1/20 0.30
CYP3A4 P08684 1/20 0.30

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
SCHEMBL10100190 0.88 ODC1 (0.35) ODC1
SCHEMBL20987853 0.84 ODC1 (0.32) ODC1CYP3A4
SCHEMBL17994099 0.83
SCHEMBL10027675 0.81 ODC1 (0.36) ODC1
SCHEMBL8165469 0.80 ALDH1A1 (0.32)
SCHEMBL10100188 0.79 ODC1 (0.35) ODC1
SCHEMBL29300445 0.79 ODC1 (0.35) ODC1
SCHEMBL21095351 0.79 ODC1 (0.32) ODC1
SCHEMBL19135697 0.79
SCHEMBL15170745 0.78 FDPS (0.30)

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-2020002128-A1 COMPOSITION COMPRISING A PARTICULAR DOUBLE SALT OF A DIAMMONIUM AND CARBOXYLATE(S), METHOD AND USE THEREOF L'OREAL (FR) 2020-01-02 WO disclosed