SCHEMBL17087922

SCHEMBL17087922

CCCC1OC(CO)C(O)C1O

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LGALS1 P09382 2/20 0.45
LGALS3 P17931 2/20 0.45
LGALS9 O00182 1/20 0.45
LGALS8 O00214 1/20 0.45
PYGB P11216 3/20 0.44
GAA P10253 1/20 0.43
OGA O60502 4/20 0.41
HEXA P06865 1/20 0.38
HEXB P07686 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
MAPT P10636 1/20 0.37
ALDH1A1 P00352 1/20 0.37
TSHR P16473 1/20 0.37

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
SCHEMBL388109 1.00 LGALS1 (0.45) LGALS1LGALS3LGALS9LGALS8PYGB
SCHEMBL757840 0.98 LGALS1 (0.48) LGALS1LGALS3LGALS9LGALS8PYGB
SCHEMBL3290529 0.98 LGALS1 (0.48) LGALS1LGALS3LGALS9LGALS8PYGB
SCHEMBL26987277 0.98 LGALS1 (0.48) LGALS1LGALS3LGALS9LGALS8PYGB
SCHEMBL3292990 0.98 LGALS1 (0.48) LGALS1LGALS3LGALS9LGALS8PYGB
SCHEMBL23848867 0.87 PYGB (0.44) LGALS1LGALS3LGALS9LGALS8PYGB
SCHEMBL9621629 0.86 OGA (0.42) LGALS1LGALS3LGALS9LGALS8PYGB
SCHEMBL23848979 0.86 PYGB (0.39) LGALS1LGALS3LGALS9LGALS8PYGB
SCHEMBL17081176 0.86 PYGB (0.39) LGALS1LGALS3LGALS9LGALS8PYGB
SCHEMBL23848959 0.86 PYGB (0.39) LGALS1LGALS3LGALS9LGALS8PYGB

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-9663548-B2 10-α/β-D-arabinofuranosyl-undecenes as potential anti-mycobacterial agents and process for the preparation thereof COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2017-05-30 US disclosed
US-20150259372-A1 10-a/BETA-D-ARABINOFURANOSYL-UNDECENES AS POTENTIAL ANTI-MYCOBACTERIAL AGENTS AND PROCESS FOR THE PREPARATION THEREOF COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2015-09-17 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-20150259372-A1 10-a/BETA-D-ARABINOFURANOSYL-UNDECENES AS POTENTIAL ANTI-MYCOBACTERIAL AGENTS AND PROCESS FOR THE PREPARATION THEREOF DCXR, DHPS, MANBA LGALS1 868/4885LGALS3 1979/4885LGALS9 663/4885

“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.