SCHEMBL2268464

SCHEMBL2268464

OCCCCCCCCCN1CC(O)C(O)C1CO

nearest known ligand 0.75

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
AGL P35573 1/20 0.72
GBA2 Q9HCG7 13/20 0.68
GBA1 P04062 8/20 0.68
GAA P10253 5/20 0.68
UGCG Q16739 1/20 0.68
TDP1 Q9NUW8 1/20 0.65
MGAM O43451 1/20 0.65
LCT P09848 1/20 0.65
SI P14410 1/20 0.65

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
SCHEMBL8969835 1.00 AGL (0.72) AGLGBA2GBA1GAAUGCG
SCHEMBL8969769 0.98 AGL (0.75) AGLGBA2GBA1GAAUGCG
SCHEMBL2271682 0.95 GBA2 (0.76) GBA2GBA1GAAUGCGTDP1
SCHEMBL2439683 0.95 GBA2 (0.76) GBA2GBA1GAAUGCGTDP1
SCHEMBL2437447 0.93 GBA1 (0.76) GBA2GBA1GAAUGCGTDP1
SCHEMBL8969740 0.92 AGL (0.78) AGLGBA2GBA1GAAUGCG
SCHEMBL8969964 0.86 GBA2 (0.90) GBA2GBA1GAAUGCG
SCHEMBL8969159 0.86 GBA2 (0.90) GBA2GBA1GAAUGCG
SCHEMBL8969848 0.86 GBA2 (0.90) GBA2GBA1GAAUGCG
SCHEMBL2436236 0.86 GBA2 (0.90) GBA2GBA1GAAUGCG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110237538-A1 TREATMENT OF LYSOSOMAL STORAGE DISORDERS AND OTHER PROTEOSTATIC DISEASES SUMMIT CORPORATION PLC (GB) 2011-09-29 US disclosed
US-20110195929-A1 COMPOUNDS FOR THE TREATMENT OF FLAVIVIRAL INFECTIONS SUMMIT CORPORATION PLC (GB) 2011-08-11 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 (2 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-20110237538-A1 TREATMENT OF LYSOSOMAL STORAGE DISORDERS AND OTHER PROTEOSTATIC DISEASES GAA, MAN2B1, GBA1 AGL 71/4885GBA2 5/4885GBA1 3/4885
US-20110195929-A1 COMPOUNDS FOR THE TREATMENT OF FLAVIVIRAL INFECTIONS GPI, GALE, HAVCR2 AGL 65/4885GBA2 106/4885GBA1 18/4885

“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.