SCHEMBL25957526

SCHEMBL25957526

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

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ PYGB P11216 1/20 0.36
▸ ADORA1 P30542 2/20 0.35
▸ ACHE P22303 8/20 0.34
▸ PRKACA P17612 2/20 0.33
▸ AMDHD2 Q9Y303 1/20 0.32
▸ TLR4 O00206 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ CYP2D6 P10635 1/20 0.31
▸ CYP2C19 P33261 1/20 0.31
▸ MAPK1 P28482 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
SCHEMBL25835148 1.00 PYGB (0.36) PYGBADORA1ACHEPRKACAAMDHD2
SCHEMBL21138017 0.86 PYGB (0.38) PYGBADORA1ACHEPRKACAAMDHD2
SCHEMBL21058398 0.86 PYGB (0.38) PYGBADORA1ACHEPRKACAAMDHD2
SCHEMBL21137932 0.80 PYGB (0.39) PYGBAMDHD2TLR4KDM4ELMNA
SCHEMBL25835074 0.80 PYGB (0.39) PYGBAMDHD2TLR4KDM4ELMNA
SCHEMBL23104926 0.80 PYGB (0.39) PYGBAMDHD2TLR4KDM4ELMNA
SCHEMBL21137933 0.80 PYGB (0.39) PYGBAMDHD2TLR4KDM4ELMNA
SCHEMBL21138298 0.78 PYGB (0.53) PYGBTLR4KDM4ELMNACYP2D6
SCHEMBL21138012 0.78 PYGB (0.53) PYGBTLR4KDM4ELMNACYP2D6
SCHEMBL21058338 0.78 MEN1 (0.36) PYGBTLR4

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-11718636-B2 Glucosamine derivatives for the prevention or treatment of joint disorders Risen (Suzhou) Pharma Tech Co., Ltd. (CN) 2023-08-08 — — 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-11718636-B2 Glucosamine derivatives for the prevention or treatment of joint disorders OGT, UGGT1, GLA PYGB 760/4885ADORA1 902/4885ACHE 347/4885

“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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