SCHEMBL2435939

SCHEMBL2435939

OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1Cc1ccccc1

nearest known ligand 0.68

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MGAM O43451 6/20 0.68
GAA P10253 5/20 0.68
GBA1 P04062 5/20 0.66
UGCG Q16739 2/20 0.60
GBA2 Q9HCG7 2/20 0.60
FUCA1 P04066 2/20 0.60
TDP1 Q9NUW8 1/20 0.53

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
SCHEMBL7911362 1.00 MGAM (0.68) MGAMGAAGBA1UGCGGBA2
SCHEMBL7908085 1.00 MGAM (0.68) MGAMGAAGBA1UGCGGBA2
SCHEMBL2266205 1.00 MGAM (0.68) MGAMGAAGBA1UGCGGBA2
SCHEMBL7908086 1.00 MGAM (0.68) MGAMGAAGBA1UGCGGBA2
SCHEMBL7911388 1.00 MGAM (0.68) MGAMGAAGBA1UGCGGBA2
SCHEMBL7912849 0.95 GBA1 (0.72) MGAMGAAGBA1UGCGGBA2
SCHEMBL7911357 0.95 GBA1 (0.72) MGAMGAAGBA1UGCGGBA2
SCHEMBL6135325 0.95 GBA1 (0.72) MGAMGAAGBA1UGCGGBA2
SCHEMBL2433104 0.95 GBA1 (0.72) MGAMGAAGBA1UGCGGBA2
SCHEMBL2268885 0.95 GBA1 (0.72) MGAMGAAGBA1UGCGGBA2

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-4871747-A 3-Amino-4,5-dihydroxypiperidines, process for their preparation and their use BAYER AKTIENGESELLSCHAFT (DE) 1989-10-03 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-20110237538-A1 TREATMENT OF LYSOSOMAL STORAGE DISORDERS AND OTHER PROTEOSTATIC DISEASES GAA, MAN2B1, GBA1 MGAM 36/4885GAA 1/4885GBA1 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.