SCHEMBL4422178

SCHEMBL4422178

BrCCCCCOCC12CC3CC(CC(C3)C1)C2

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GBA2 Q9HCG7 18/20 0.54
GBA1 P04062 6/20 0.50
UGCG Q16739 5/20 0.48
MGAM O43451 2/20 0.48
GAA P10253 2/20 0.48
SI P14410 2/20 0.48
AGL P35573 2/20 0.48
LCT P09848 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
SCHEMBL13668757 0.81 GBA2 (0.57) GBA2GBA1UGCGMGAMGAA
SCHEMBL13672852 0.80 GBA2 (0.52) GBA2GBA1UGCGMGAMGAA
SCHEMBL13668744 0.79 GBA2 (0.51) GBA2GBA1UGCGMGAMGAA
SCHEMBL24586992 0.77 ALDH1A1 (0.44) GBA2GBA1
SCHEMBL24587719 0.77 ALDH1A1 (0.44) GBA2GBA1
SCHEMBL13668762 0.76 GBA2 (0.52) GBA2GBA1UGCGMGAMGAA
SCHEMBL16451614 0.76 GBA2 (0.48) GBA2GBA1UGCGMGAMGAA
SCHEMBL4419614 0.75 GBA2 (0.48) GBA2GBA1UGCGMGAMGAA
SCHEMBL14601217 0.75 GBA2 (0.51) GBA2GBA1UGCGMGAMGAA
SCHEMBL24587010 0.75 ALDH1A1 (0.45) GBA2

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1680403-B1 DEOXYNOJIRIMYCIN ANALOGUES AND THEIR USES AS GLUCOSYLCERAMIDASE INHIBITORS GENZYME CORP (US) 2016-06-29 EP disclosed
EP-1680403-B1 DEOXYNOJIRIMYCIN ANALOGUES AND THEIR USES AS GLUCOSYLCERAMIDASE INHIBITORS GENZYME CORP (US) 2016-06-29 EP disclosed
US-7528153-B2 Deoxynojirimycin analogues and their uses as glucosylceramidase inhibitors GENZYME CORPORATION (US) 2009-05-05 US disclosed
US-20070066581-A1 Deoxynojirimycin analogues and their uses as glucosylceramidase inhibitors GENZYME CORPORATION 2007-03-22 US disclosed
EP-1528056-A1 Deoxynojirimycin analogues and their uses as glucosylceramidase inhibitors Academisch Ziekenhuis bij de Universiteit van Amsterdam (NL) 2005-05-04 EP 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-20070066581-A1 Deoxynojirimycin analogues and their uses as glucosylceramidase inhibitors GAA, GBA1, GBA3 GBA2 9/4885GBA1 2/4885UGCG 6/4885

“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.