SCHEMBL25835418

SCHEMBL25835418

CCCC(=O)NC1C(C)OC(CO)C(O)C1OC(=O)[C@@H](N)C(C)C

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PYGB P11216 2/20 0.44
▸ ALDH1A1 P00352 2/20 0.37
▸ THRB P10828 1/20 0.37
▸ MAPK1 P28482 2/20 0.36
▸ TLR4 O00206 6/20 0.34
▸ LY96 Q9Y6Y9 6/20 0.33
▸ GAA P10253 1/20 0.33
▸ LGALS8 O00214 2/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ CA1 P00915 1/20 0.32
▸ CA2 P00918 1/20 0.32
▸ CA9 Q16790 1/20 0.32
▸ SLC5A1 P13866 1/20 0.32
▸ SLC5A2 P31639 1/20 0.32

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
SCHEMBL25957853 0.90 MAPK1 (0.47) PYGBALDH1A1THRBMAPK1TLR4
SCHEMBL28889012 0.90 MAPK1 (0.47) PYGBALDH1A1THRBMAPK1TLR4
SCHEMBL21137905 0.90 MAPK1 (0.47) PYGBALDH1A1THRBMAPK1TLR4
SCHEMBL29777467 0.90 MAPK1 (0.47) PYGBALDH1A1THRBMAPK1TLR4
Hydrochloric Acid SCHEMBL21058344 0.89 MAPK1 (0.46) PYGBALDH1A1THRBMAPK1TLR4
SCHEMBL21137920 0.89 PYGB (0.44) PYGBALDH1A1THRBMAPK1TLR4
Hydrochloric Acid SCHEMBL30033750 0.89 MAPK1 (0.46) PYGBALDH1A1THRBMAPK1TLR4
Hydrochloric Acid SCHEMBL31731457 0.88 PYGB (0.44) PYGBALDH1A1THRBMAPK1TLR4
Hydrochloric Acid SCHEMBL21058386 0.88 PYGB (0.44) PYGBALDH1A1THRBMAPK1TLR4
SCHEMBL23104642 0.78 PYGB (0.46) PYGBALDH1A1THRBMAPK1TLR4

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-11718636-B2 Glucosamine derivatives for the prevention or treatment of joint disorders Risen (Suzhou) Pharma Tech Co., Ltd. (CN) 2023-08-08 — — US disclosed
US-20230227488-A1 GLUCOSAMINE DERIVATIVES AND PHARMACEUTICAL USES THEREOF RISEN SUZHOU PHARMA TECH CO LTD (CN) 2023-07-20 — — 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-11718636-B2 Glucosamine derivatives for the prevention or treatment of joint disorders OGT, UGGT1, GLA PYGB 760/4885ALDH1A1 1901/4885THRB 1546/4885
US-20230227488-A1 GLUCOSAMINE DERIVATIVES AND PHARMACEUTICAL USES THEREOF OGT, UGGT1, GLA PYGB 601/4885ALDH1A1 1600/4885THRB 1526/4885

“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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