SCHEMBL25835598

SCHEMBL25835598

CCCC(=O)N[C@H]1C(O)O[C@H](COC(=O)CCCCCCCC(C)=O)[C@@H](O)[C@@H]1O

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ TLR4 O00206 8/20 0.40
▸ PYGB P11216 1/20 0.39
▸ PTGS1 P23219 1/20 0.37
▸ PTGS2 P35354 1/20 0.37
▸ MAPK1 P28482 1/20 0.35
▸ SLC2A1 P11166 1/20 0.35
▸ LY96 Q9Y6Y9 6/20 0.35
▸ AMDHD2 Q9Y303 1/20 0.34
▸ KDM4E B2RXH2 1/20 0.34
▸ LMNA P02545 1/20 0.34

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
SCHEMBL21137910 0.93 TLR4 (0.44) TLR4PYGBMAPK1LY96
SCHEMBL31353005 0.93 TLR4 (0.44) TLR4PYGBMAPK1LY96
SCHEMBL21058358 0.91 TLR4 (0.42) TLR4PYGBPTGS1PTGS2SLC2A1
SCHEMBL21137953 0.89 PYGB (0.45) TLR4PYGBPTGS1PTGS2MAPK1
SCHEMBL21138039 0.89 PYGB (0.45) TLR4PYGBPTGS1PTGS2MAPK1
SCHEMBL21137960 0.87 PYGB (0.40) TLR4PYGBPTGS1PTGS2SLC2A1
SCHEMBL21137917 0.87 PYGB (0.40) TLR4PYGBPTGS1PTGS2MAPK1
Hydrochloric Acid SCHEMBL21058362 0.86 PYGB (0.39) TLR4PYGBPTGS1PTGS2SLC2A1
SCHEMBL21138675 0.86 PYGB (0.39) TLR4PYGBPTGS1PTGS2MAPK1
SCHEMBL21138044 0.86 PYGB (0.48) TLR4PYGBPTGS1PTGS2SLC2A1

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 TLR4 660/4885PYGB 760/4885PTGS1 271/4885
US-20230227488-A1 GLUCOSAMINE DERIVATIVES AND PHARMACEUTICAL USES THEREOF OGT, UGGT1, GLA TLR4 896/4885PYGB 601/4885PTGS1 313/4885

“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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