SCHEMBL2269497

SCHEMBL2269497

NC(=O)C[C@@H]1[C@H](O)[C@H](O)[C@@H](CO)N1CCO

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MGAM O43451 4/20 0.43
FUCA1 P04066 1/20 0.39
GAA P10253 4/20 0.38
GBA1 P04062 2/20 0.38
TDP1 Q9NUW8 1/20 0.38
LCT P09848 1/20 0.38
SI P14410 1/20 0.38
AGL P35573 1/20 0.35

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
SCHEMBL2267141 0.86 MGAM (0.46) MGAMFUCA1GAAGBA1
SCHEMBL2273447 0.83 MGAM (0.69) MGAMGAAGBA1SIAGL
SCHEMBL4106580 0.82 MGAM (0.58) MGAMFUCA1GAAGBA1TDP1
SCHEMBL13848042 0.82 MGAM (0.58) MGAMFUCA1GAAGBA1TDP1
SCHEMBL14624581 0.82 MGAM (0.58) MGAMFUCA1GAAGBA1TDP1
SCHEMBL14624899 0.82 MGAM (0.58) MGAMFUCA1GAAGBA1TDP1
SCHEMBL13004948 0.82 MGAM (0.58) MGAMFUCA1GAAGBA1TDP1
SCHEMBL2438771 0.82 MGAM (0.58) MGAMFUCA1GAAGBA1TDP1
SCHEMBL2270084 0.80 MGAM (0.60) MGAMGAAGBA1
SCHEMBL12497891 0.80 MGAM (0.60) MGAMGAAGBA1

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 MGAM 36/4885FUCA1 17/4885GAA 1/4885
US-20110195929-A1 COMPOUNDS FOR THE TREATMENT OF FLAVIVIRAL INFECTIONS GPI, GALE, HAVCR2 MGAM 43/4885FUCA1 83/4885GAA 107/4885

“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.