SCHEMBL25957461

SCHEMBL25957461

CCCC(=O)N[C@H]1C(O)O[C@H](COC(=O)C(C)c2ccc(CCC)cc2)[C@@H](O)[C@@H]1O

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ SLC2A1 P11166 1/20 0.36
▸ PYGB P11216 1/20 0.35
▸ ACACB O00763 2/20 0.35
▸ HK1 P19367 4/20 0.35
▸ HK2 P52789 4/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ ACACA Q13085 1/20 0.33
▸ SSTR2 P30874 3/20 0.33
▸ SSTR3 P32745 3/20 0.33
▸ SSTR5 P35346 3/20 0.33
▸ SSTR1 P30872 1/20 0.33
▸ SSTR4 P31391 1/20 0.33
▸ PTGS2 P35354 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
SCHEMBL21058347 0.92 PTGS2 (0.43) PTGS2
SCHEMBL25957856 0.91 ACACB (0.34) SLC2A1PYGBACACBALDH1A1SMN1; SMN2
SCHEMBL21138772 0.83 PTGS2 (0.42) PTGS2
SCHEMBL25957583 0.82 PTGS2 (0.37) PTGS2
Hydrochloric Acid SCHEMBL31353002 0.80 PYGB (0.41) PYGBHK1HK2ALDH1A1
SCHEMBL21137980 0.78 PYGB (0.40) PYGBHK1HK2ALDH1A1SLC5A1
SCHEMBL28855878 0.78 PYGB (0.40) PYGBHK1HK2ALDH1A1SLC5A1
SCHEMBL21137857 0.77 HK1 (0.41) HK1HK2SSTR4
Hydrochloric Acid SCHEMBL29777443 0.77 PYGB (0.39) PYGBHK1HK2ALDH1A1SLC5A1
Hydrochloric Acid SCHEMBL21058387 0.77 PYGB (0.39) PYGBHK1HK2ALDH1A1SLC5A1

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 SLC2A1 34/4885PYGB 760/4885ACACB 739/4885

“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.

Send feedback