SCHEMBL13758784

SCHEMBL13758784

O=C(O)C1C[C@H](O)[C@H](O)C(=O)O1

nearest known ligand 0.44

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
IDUA P35475 1/20 0.36
GUSB P08236 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.33
LMNA P02545 1/20 0.31
GBA1 P04062 1/20 0.31

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
SCHEMBL17678526 1.00 IDUA (0.36) IDUAGUSBSMN1; SMN2LMNAGBA1
SCHEMBL4063270 0.78 SMN1; SMN2 (0.35) IDUAGUSBSMN1; SMN2
SCHEMBL9218081 0.72 SMN1; SMN2 (0.34) SMN1; SMN2
SCHEMBL13045595 0.72 GABRR1 (0.36) SMN1; SMN2
SCHEMBL9745576 0.72 SMN1; SMN2 (0.34) SMN1; SMN2
SCHEMBL2806987 0.72 POLB (0.43) SMN1; SMN2LMNA
SCHEMBL19215282 0.70 KMT2A (0.40) IDUAGUSBSMN1; SMN2LMNAGBA1
SCHEMBL12292959 0.68 SMN1; SMN2 (0.34) SMN1; SMN2
SCHEMBL188282 0.68 SMN1; SMN2 (0.32) SMN1; SMN2
SCHEMBL17931566 0.67 LMNA (0.44) LMNAGBA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7563896-B2 Process of obtaining type II dehydroquinase enzyme inhibitors and precursors thereof UNIVERSIDADE DE SANTIAGO DE COMPOSTELA (ES) 2009-07-21 US disclosed
US-20070185214-A1 Process of obtaining type II dehydroquinase enzyme inhibitors and precursors thereof UNIVERSIDADE DE SANTIAGO DE COMPOSTELA (ES) 2007-08-09 US disclosed
US-20070185214-A1 Process of obtaining type II dehydroquinase enzyme inhibitors and precursors thereof UNIVERSIDADE DE SANTIAGO DE COMPOSTELA (ES) 2007-08-09 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-20070185214-A1 Process of obtaining type II dehydroquinase enzyme inhibitors and precursors thereof NQO2, CYP1A2, HPD IDUA 210/4885GUSB 202/4885SMN1; SMN2 4416/4885

“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.