SCHEMBL6276166

SCHEMBL6276166

COC(=O)C(CN)N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CA14 Q9ULX7 3/20 0.34
CA12 O43570 2/20 0.34
CA1 P00915 3/20 0.34
CA2 P00918 3/20 0.34
DGAT1 O75907 1/20 0.33
HDAC6 Q9UBN7 2/20 0.32
HDAC1 Q13547 1/20 0.32
HDAC2 Q92769 1/20 0.32
AAK1 Q2M2I8 2/20 0.31
CA7 P43166 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
SCHEMBL10140429 0.85 CA14 (0.31) CA14CA12CA1CA2
SCHEMBL9634202 0.84 CA14 (0.36) CA14CA12CA1CA2DGAT1
SCHEMBL9634197 0.84 CA14 (0.36) CA14CA12CA1CA2DGAT1
SCHEMBL15562451 0.81 CA14 (0.36) CA14CA12CA1CA2DGAT1
SCHEMBL15455290 0.81 CA14 (0.36) CA14CA12CA1CA2DGAT1
SCHEMBL16284716 0.80 CA14 (0.33) CA14CA12CA1CA2DGAT1
SCHEMBL3602393 0.80 HDAC6 (0.36) CA14CA12CA1CA2DGAT1
SCHEMBL12475550 0.80 CTSK (0.35) CA14CA12CA1CA2DGAT1
SCHEMBL12475555 0.80 CTSK (0.35) CA14CA12CA1CA2DGAT1
SCHEMBL15434471 0.79 CA14 (0.32) CA14CA1CA2

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-6958395-B2 Method for producing water-soluble saccharide conjugates and saccharide mimetics by Diels-Alder reaction DEUTSCHES KREBSFORSCHUNGSZENTRUM STIFTUNG DES OFFENTLICHEN RECHTS (DE) 2005-10-25 US disclosed
US-20040059101-A1 Method for producing water-soluble saccharide conjugates and saccharide mimetics by diels-alder reaction DEUTSCHES KREBSFORSCHUNGSZENTRUM STIFTUNG DES OFFENTLICHEN RECHTS (DE) 2004-03-25 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-20040059101-A1 Method for producing water-soluble saccharide conjugates and saccharide mimetics by diels-alder reaction SI, MAN1B1, SORD CA14 51/4885CA12 102/4885CA1 132/4885

“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.