SCHEMBL13994673

SCHEMBL13994673

CO[C@H]1C(O)C(O)[C@H](O[C@@H]2C(NC(C)=O)[C@H](C)OC(CO)[C@H]2O)C[C@H]1C(C)=O

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 2/20 0.41
▸ CD69 Q07108 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.37
▸ THRB P10828 1/20 0.37
▸ LGALS3 P17931 6/20 0.35
▸ LGALS8 O00214 3/20 0.35
▸ LGALS4 P56470 1/20 0.35
▸ LGALS1 P09382 1/20 0.35
▸ LGALS7; LGALS7B P47929 1/20 0.35
▸ LGALS9 O00182 1/20 0.34
▸ PYGB P11216 1/20 0.33

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
SCHEMBL16016954 0.87 CD69 (0.43) MAPK1CD69ALDH1A1THRBLGALS3
SCHEMBL13994672 0.85 MAPK1 (0.40) MAPK1CD69ALDH1A1THRBLGALS3
SCHEMBL23603141 0.83 MAPK1 (0.52) MAPK1CD69ALDH1A1THRBLGALS3
SCHEMBL21077729 0.83 MAPK1 (0.52) MAPK1CD69ALDH1A1THRBLGALS3
SCHEMBL13864090 0.83 MAPK1 (0.52) MAPK1CD69ALDH1A1THRBLGALS3
SCHEMBL14113910 0.82 LGALS3 (0.43) MAPK1CD69ALDH1A1THRBLGALS3
SCHEMBL25964076 0.81 MAPK1 (0.41) MAPK1CD69ALDH1A1THRBLGALS3
SCHEMBL2602688 0.79 LGALS3 (0.49) MAPK1CD69ALDH1A1THRBLGALS3
SCHEMBL12213975 0.79 LGALS3 (0.45) MAPK1CD69ALDH1A1THRBLGALS3
SCHEMBL12214021 0.79 LGALS3 (0.45) MAPK1CD69ALDH1A1THRBLGALS3

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-20080306023-A1 Derivatives of Hyaluronic Acid, Their Preparation Process and Their Uses CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2008-12-11 — — 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-20080306023-A1 Derivatives of Hyaluronic Acid, Their Preparation Process and Their Uses CD44, F12, F11 MAPK1 1602/4885CD69 1600/4885ALDH1A1 501/4885

“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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