SCHEMBL2433156

SCHEMBL2433156

O=C(NC[C@H]1NC[C@H](O)[C@@H]1O)c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAN1B1 Q9UKM7 12/20 0.57
MAN2A1 Q16706 10/20 0.53
MAN2B1 O00754 2/20 0.52
FUCA1 P04066 1/20 0.51
OPRM1 P35372 1/20 0.48
GLA P06280 2/20 0.47
ADRB1 P08588 1/20 0.46

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
SCHEMBL1860576 0.83 MAN1B1 (0.43) MAN1B1MAN2A1FUCA1OPRM1
SCHEMBL10353965 0.74 OPRM1 (0.58) OPRM1ADRB1
SCHEMBL4956356 0.74 CTSL (0.59) OPRM1ADRB1
SCHEMBL19557582 0.73 FUCA1 (0.90) MAN1B1MAN2A1FUCA1GLA
SCHEMBL15593211 0.73 FUCA1 (0.90) MAN1B1MAN2A1FUCA1GLA
SCHEMBL15593229 0.73 FUCA1 (0.90) MAN1B1MAN2A1FUCA1GLA
SCHEMBL19557585 0.73 FUCA1 (0.90) MAN1B1MAN2A1FUCA1GLA
SCHEMBL2303341 0.71 HDAC3 (0.64)
SCHEMBL30426179 0.70 CTSL (0.57) OPRM1
SCHEMBL21578194 0.69 MAN1B1 (0.64) MAN1B1MAN2A1MAN2B1

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-20110237538-A1 TREATMENT OF LYSOSOMAL STORAGE DISORDERS AND OTHER PROTEOSTATIC DISEASES SUMMIT CORPORATION PLC (GB) 2011-09-29 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-20110237538-A1 TREATMENT OF LYSOSOMAL STORAGE DISORDERS AND OTHER PROTEOSTATIC DISEASES GAA, MAN2B1, GBA1 MAN1B1 23/4885MAN2A1 11/4885MAN2B1 2/4885

“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.