SCHEMBL25957442

SCHEMBL25957442

CCCC(=O)N[C@H]1C(O)O[C@H](COC(=O)[C@H](CC)NC(=O)OC(C)(C)C)[C@@H](O)[C@@H]1O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CTSK P43235 5/20 0.36
▸ CTSS P25774 3/20 0.36
▸ PYGB P11216 1/20 0.35
▸ CYP2C19 P33261 2/20 0.34
▸ CYP1A2 P05177 1/20 0.34
▸ CYP2C9 P11712 1/20 0.34
▸ HTT P42858 1/20 0.34
▸ ALDH1A1 P00352 3/20 0.33
▸ KDM4E B2RXH2 2/20 0.33
▸ GLA P06280 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ TSHR P16473 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ TLR4 O00206 1/20 0.33
▸ CAPN1 P07384 1/20 0.32
▸ ACE P12821 1/20 0.31
▸ THRB P10828 1/20 0.31
▸ SMN1; SMN2 Q16637 2/20 0.31
▸ MEN1 O00255 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
SCHEMBL31353010 0.91 CAPN1 (0.40) CTSKCTSSPYGBCYP2C19CYP1A2
SCHEMBL21058397 0.87 CTSK (0.35) CTSKCTSSPYGBCYP2C19KDM4E
SCHEMBL21137891 0.87 CTSK (0.35) CTSKCTSSPYGBCYP2C19KDM4E
SCHEMBL21058353 0.86 ACE (0.48) CTSKCTSSACEKMT2A
SCHEMBL23104921 0.83 CTSK (0.36) CTSKCTSSCYP2C19CYP1A2CYP2C9
SCHEMBL21058382 0.83 ITGB3 (0.38) CTSKCTSSACE
SCHEMBL21138668 0.83 ITGB3 (0.38) CTSKCTSSACE
SCHEMBL21137896 0.81 SDCBP (0.32) CTSKCTSSPYGB
SCHEMBL21138004 0.79 MEN1 (0.36) PYGBGAATLR4MEN1KMT2A
SCHEMBL21058338 0.79 MEN1 (0.36) PYGBGAATLR4MEN1KMT2A

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-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 CTSK 577/4885CTSS 1085/4885PYGB 760/4885

“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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