SCHEMBL6807316

SCHEMBL6807316

C#C[C@H](C)C(N)(O)C(=O)OC(C)(C)C

nearest known ligand 0.45

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 1/20 0.45
CA12 O43570 1/20 0.30
CA14 Q9ULX7 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
SCHEMBL1250922 0.75 DGAT1 (0.41) DGAT1CA12CA14
SCHEMBL4449736 0.71 DGAT1 (0.41) DGAT1
SCHEMBL4448260 0.71 DGAT1 (0.41) DGAT1
SCHEMBL5895740 0.70 DGAT1 (0.44) DGAT1CA12CA14
SCHEMBL5895747 0.70 DGAT1 (0.44) DGAT1CA12CA14
SCHEMBL10892362 0.69 DGAT1 (0.48) DGAT1
SCHEMBL1061233 0.69 DGAT1 (0.48) DGAT1
SCHEMBL2141980 0.68 DGAT1 (0.54) DGAT1CA12CA14
SCHEMBL27765256 0.68 DGAT1 (0.46) DGAT1
SCHEMBL16171890 0.67 CA1 (0.36) DGAT1CA12CA14

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-20040132784-A1 Amino alcohol derivatives SANKYO COMPANY, LIMITED (JP) 2004-07-08 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-20040132784-A1 Amino alcohol derivatives CD4, ADH1C, ADH1A DGAT1 2640/4885CA12 2546/4885CA14 2628/4885

“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.