SCHEMBL5428454

SCHEMBL5428454

CC(O)OC(=O)CC(N)C(=O)OC(C)O

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MMP1 P03956 1/20 0.34
▸ MMP2 P08253 1/20 0.34
▸ MMP3 P08254 1/20 0.34
▸ MMP9 P14780 1/20 0.34
▸ MMP13 P45452 1/20 0.34
▸ PRKCA P17252 1/20 0.33
▸ GRIK1 P39086 2/20 0.31
▸ GRIK2 Q13002 2/20 0.31
▸ SLC7A5 Q01650 1/20 0.31
▸ MGAM O43451 1/20 0.30
▸ GAA P10253 1/20 0.30
▸ SI P14410 1/20 0.30
▸ MGAM2 Q2M2H8 1/20 0.30

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
SCHEMBL11119408 0.83 LMNA (0.31) SLC7A5
SCHEMBL13475076 0.83 MMP1 (0.34) MMP1MMP2MMP3MMP9MMP13
SCHEMBL6435729 0.81 LMNA (0.39) MMP1MMP2MMP3MMP9MMP13
SCHEMBL6435735 0.81 LMNA (0.39) MMP1MMP2MMP3MMP9MMP13
SCHEMBL5424012 0.80 SLC1A1 (0.35) GRIK1GRIK2
Hydrochloric Acid SCHEMBL6946979 0.79 LMNA (0.38) MMP1MMP2MMP3MMP9MMP13
SCHEMBL5586415 0.78 MMP1 (0.36) MMP1MMP2MMP3MMP9MMP13
SCHEMBL23120327 0.76 MMP1 (0.40) MMP1MMP2MMP3MMP9MMP13
SCHEMBL23120273 0.76 MMP1 (0.49) MMP1MMP2MMP3MMP9MMP13
SCHEMBL12332086 0.75 MMP1 (0.40) MMP1MMP2MMP3MMP9MMP13

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7273845-B2 Polymeric prodrugs of vancomycin ENZON PHARMACEUTICALS, INC. (US) 2007-09-25 — — US disclosed
US-7169892-B2 Lipid-peptide-polymer conjugates for long blood circulation and tumor specific drug delivery systems ASTELLAS PHARMA INC. (JP) 2007-01-30 — — US disclosed
EP-1591450-A1 CONJUGATE FOR RETENTION IN BLOOD AND CANCER TISSUE-SPECIFIC DRUG DELIVERY YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 2005-11-02 — — EP disclosed
US-20050054026-A1 Lipid-peptide-polymer conjugates for long blood circulation and tumor specific drug delivery systems YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 2005-03-10 — — US disclosed
US-20040136947-A1 vancomycin-polymer conjugate; polymer is attached to both of the vancomycin amino groups BELROSE PHARMA INC. 2004-07-15 — — US disclosed
WO-2004044224-A2 BRANCHED POLYMERIC PRODRUGS OF VANCOMYCIN ENZON PHARMACEUTICALS, INC. (US) 2004-05-27 — — WO disclosed
WO-2004044222-A2 POLYMERIC PRODRUGS OF VANCOMYCIN ENZON PHARMACEUTICALS, INC. (US) 2004-05-27 — — WO 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-20040136947-A1 vancomycin-polymer conjugate; polymer is attached to both of the vancomycin amino groups DNPEP, NPEPPS, DDOST MMP1 2780/4885MMP2 584/4885MMP3 1640/4885

“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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