SCHEMBL5324079

SCHEMBL5324079

OCC1CN(Cc2ccc(-c3ccccc3)cc2)CC(O)C1O

nearest known ligand 0.83

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 12/20 0.83
FUCA1 P04066 2/20 0.62
PYGL P06737 1/20 0.59
CYP2D6 P10635 1/20 0.52

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
SCHEMBL2713362 1.00 GBA1 (0.83) GBA1FUCA1PYGLCYP2D6
SCHEMBL2713369 1.00 GBA1 (0.83) GBA1FUCA1PYGLCYP2D6
SCHEMBL5327603 0.91 GBA1 (1.00) GBA1FUCA1PYGL
SCHEMBL8186647 0.91 GBA1 (1.00) GBA1FUCA1PYGL
SCHEMBL2713933 0.91 GBA1 (1.00) GBA1FUCA1PYGL
SCHEMBL24008565 0.88 FUCA1 (0.74) GBA1FUCA1CYP2D6
SCHEMBL2268869 0.88 FUCA1 (0.80) GBA1FUCA1CYP2D6
SCHEMBL30287840 0.88 FUCA1 (0.74) GBA1FUCA1CYP2D6
SCHEMBL1857553 0.88 FUCA1 (0.80) GBA1FUCA1CYP2D6
SCHEMBL8187999 0.85 GBA1 (0.77) GBA1FUCA1PYGL

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-2007150064-A2 METHOD FOR THE TREATMENT OF NEUROLOGICAL DISORDERS BY ENHANCING THE ACTIVITY OF β-GLUCOCEREBROSIDASE AMICUS THERAPEUTICS, INC. (US) 2007-12-27 WO disclosed