SCHEMBL18393015

SCHEMBL18393015

CC(C)(C)[Si](C)(C)OC1OC(CO)C(O)[C@H](OC(=O)C(=O)c2ccccc2)[C@@H]1N=[N+]=[N-]

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ LGALS3 P17931 8/20 0.40
▸ LGALS9 O00182 6/20 0.40
▸ LGALS1 P09382 5/20 0.40
▸ LGALS7; LGALS7B P47929 4/20 0.40
▸ LGALS8 O00214 7/20 0.37
▸ MAOB P27338 1/20 0.33
▸ LGALS4 P56470 1/20 0.32
▸ SELP P16109 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
SCHEMBL18385940 1.00 LGALS3 (0.40) LGALS3LGALS9LGALS1LGALS7; LGALS7BLGALS8
SCHEMBL18392663 0.90 ALDH1A1 (0.35) LGALS3LGALS9LGALS1LGALS7; LGALS7B
SCHEMBL18392757 0.90 ALDH1A1 (0.35) LGALS3LGALS9LGALS1LGALS7; LGALS7B
SCHEMBL18385942 0.90 ALDH1A1 (0.35) LGALS3LGALS9LGALS1LGALS7; LGALS7B
SCHEMBL20381835 0.90 ALDH1A1 (0.35) LGALS3LGALS9LGALS1LGALS7; LGALS7B
SCHEMBL20381837 0.85 LGALS8 (0.34) LGALS8
SCHEMBL18393028 0.85 LGALS8 (0.34) LGALS8
SCHEMBL20381815 0.83 LGALS3 (0.43) LGALS3LGALS9LGALS1LGALS7; LGALS7BLGALS8
SCHEMBL18385921 0.83 ALDH1A1 (0.35) LGALS3LGALS9LGALS1LGALS7; LGALS7B
SCHEMBL20381838 0.83 ALDH1A1 (0.35) LGALS3LGALS9LGALS1LGALS7; LGALS7B

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-20170015695-A1 PREPARATION OF MONOSACCHARIDES, DISACCHARIDES, TRISACCHARIDES, AND PENTASACCHARIDES OF HEPARINOIDS FORMOSA LABORATORIES, INC. (TW) 2017-01-19 — — 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-20170015695-A1 PREPARATION OF MONOSACCHARIDES, DISACCHARIDES, TRISACCHARIDES, AND PENTASACCHARIDES OF HEPARINOIDS HPSE, DDOST, FUT5 LGALS3 174/4885LGALS9 341/4885LGALS1 237/4885

“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.

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