SCHEMBL13136604

SCHEMBL13136604

CO[C@@H]1OC(CO)C(OC2O[C@@H](CO)[C@@H](OC)C(O)C2NC(C)=O)[C@H](O)[C@@H]1NC(C)=O

nearest known ligand 0.58

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LGALS3 P17931 8/20 0.58
LGALS7; LGALS7B P47929 3/20 0.58
LGALS1 P09382 1/20 0.58
LGALS9 O00182 3/20 0.56
LGALS8 O00214 3/20 0.55
LGALS4 P56470 1/20 0.55
CD69 Q07108 1/20 0.53
CHIA Q9BZP6 1/20 0.52
ALDH1A1 P00352 1/20 0.49
THRB P10828 1/20 0.49
MAPK1 P28482 1/20 0.47
AMY2A P04746 1/20 0.44

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
SCHEMBL17953133 1.00 LGALS3 (0.58) LGALS3LGALS7; LGALS7BLGALS1LGALS9LGALS8
SCHEMBL17954599 1.00 LGALS3 (0.58) LGALS3LGALS7; LGALS7BLGALS1LGALS9LGALS8
SCHEMBL19418775 1.00 LGALS3 (0.58) LGALS3LGALS7; LGALS7BLGALS1LGALS9LGALS8
SCHEMBL10023255 1.00 LGALS3 (0.58) LGALS3LGALS7; LGALS7BLGALS1LGALS9LGALS8
SCHEMBL13784257 1.00 LGALS3 (0.58) LGALS3LGALS7; LGALS7BLGALS1LGALS9LGALS8
SCHEMBL13799095 1.00 LGALS3 (0.58) LGALS3LGALS7; LGALS7BLGALS1LGALS9LGALS8
SCHEMBL16675413 1.00 LGALS3 (0.58) LGALS3LGALS7; LGALS7BLGALS1LGALS9LGALS8
SCHEMBL15386146 1.00 LGALS3 (0.58) LGALS3LGALS7; LGALS7BLGALS1LGALS9LGALS8
SCHEMBL16476751 0.95 LGALS3 (0.54) LGALS3LGALS7; LGALS7BLGALS1LGALS9LGALS8
SCHEMBL7153592 0.95 LGALS3 (0.54) LGALS3LGALS7; LGALS7BLGALS1LGALS9LGALS8

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-20100222297-A1 CELL WALL DERIVATIVES, THEIR PREPARATION PROCESS, AND USE THEREOF KITOZYME SA (BE) 2010-09-02 US disclosed
US-20100221382-A1 CELL WALL DERIVATIVES, THEIR PREPARATION PROCESS, AND USE THEREOF KITOZYME SA 2010-09-02 US disclosed
US-20070299034-A1 Cell wall derivatives, their preparation process, and use thereof KITOZYME SA (BE) 2007-12-27 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 (2 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-20070299034-A1 Cell wall derivatives, their preparation process, and use thereof ALG1, CHIT1, MANBA LGALS3 234/4885LGALS7; LGALS7B 407/4885LGALS1 214/4885
US-20100222297-A1 CELL WALL DERIVATIVES, THEIR PREPARATION PROCESS, AND USE THEREOF ALG1, CHIT1, MANBA LGALS3 234/4885LGALS7; LGALS7B 407/4885LGALS1 214/4885

“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.