SCHEMBL3501641

SCHEMBL3501641

CCCCCCNCC[C@@H]1NC[C@@H](O)[C@H](O)[C@H]1CO

nearest known ligand 0.74

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 8/20 0.74
GLB1 P16278 7/20 0.74
GBA2 Q9HCG7 3/20 0.74
GUSB P08236 1/20 0.51
GBA3 Q9H227 1/20 0.45
SPHK1 Q9NYA1 2/20 0.41

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
SCHEMBL18191975 0.86 GBA1 (1.00) GBA1GLB1GBA2GUSBSPHK1
SCHEMBL1894899 0.86 GBA1 (1.00) GBA1GLB1GBA2GUSBSPHK1
SCHEMBL13309999 0.86 GBA1 (1.00) GBA1GLB1GBA2GUSBSPHK1
SCHEMBL3501177 0.86 GBA1 (1.00) GBA1GLB1GBA2GUSBSPHK1
SCHEMBL3502233 0.86 GBA1 (1.00) GBA1GLB1GBA2GUSBSPHK1
SCHEMBL15704037 0.86 GBA1 (1.00) GBA1GLB1GBA2GUSBSPHK1
SCHEMBL1894910 0.86 GBA1 (1.00) GBA1GLB1GBA2GUSBSPHK1
SCHEMBL1895709 0.86 GBA1 (1.00) GBA1GLB1GBA2GUSBSPHK1
SCHEMBL14312301 0.86 GBA1 (1.00) GBA1GLB1GBA2GUSBSPHK1
SCHEMBL1895630 0.86 GBA1 (1.00) GBA1GLB1GBA2GUSBSPHK1

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
US-20100189708-A1 HYDROXY PIPERIDINE DERIVATIVES TO TREAT GAUCHER DISEASE AMICUS THERAPEUTICS, INC. (US) 2010-07-29 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100189708-A1 HYDROXY PIPERIDINE DERIVATIVES TO TREAT GAUCHER DISEASE GBA1, GAA, GBA2 GBA1 1/4885GLB1 60/4885GBA2 3/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.