SCHEMBL6852785

SCHEMBL6852785

CCCCO[C@@H]1C[C@@H]2O[C@@H]2[C@H](OCCCC)C1

nearest known ligand 0.54

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PPP5C P53041 1/20 0.54
GBA1 P04062 2/20 0.34
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
SCHEMBL18605299 0.81 PPP5C (0.42) PPP5CGBA1SMN1; SMN2
SCHEMBL18603166 0.81 PPP5C (0.42) PPP5CGBA1SMN1; SMN2
SCHEMBL6840339 0.81 PPP5C (0.42) PPP5CGBA1SMN1; SMN2
SCHEMBL14210157 0.80 PPP5C (0.42) PPP5CGBA1
SCHEMBL11789856 0.78 GBA1 (0.42) PPP5CGBA1
SCHEMBL17087049 0.77 PPP5C (0.50) PPP5CGBA1SMN1; SMN2
SCHEMBL18391823 0.77 PPP5C (0.50) PPP5CGBA1SMN1; SMN2
SCHEMBL6852484 0.76 GBA1 (0.44) PPP5CGBA1SMN1; SMN2
SCHEMBL10427963 0.75 PPP5C (0.45) PPP5CGBA1SMN1; SMN2
SCHEMBL10427962 0.75 PPP5C (0.45) PPP5CGBA1SMN1; SMN2

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-2011073492-A1 DERIVATIVES OF AMINOCYCLITOLS, OBTAINMENT PROCEDURE AND USES CONSEJO SUPERIOR DE INVESTIGACIONES CIENTÍFICAS (CSIC) (ES) 2011-06-23 WO disclosed