SCHEMBL4892492

SCHEMBL4892492

O=C(O)[C@@H]1CCCN1C(=O)c1cnon1

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.53
DGAT1 O75907 5/20 0.46
CA2 P00918 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.43
ACE P12821 4/20 0.42
L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL4892496 1.00 ALDH1A1 (0.53) ALDH1A1DGAT1CA2SMN1; SMN2ACE
SCHEMBL4894867 0.76 ALDH1A1 (0.49) ALDH1A1
SCHEMBL4894873 0.76 ALDH1A1 (0.49) ALDH1A1
SCHEMBL6787964 0.75 ALDH1A1 (0.52) ALDH1A1DGAT1CA2SMN1; SMN2L3MBTL1
SCHEMBL6787956 0.75 ALDH1A1 (0.52) ALDH1A1DGAT1CA2SMN1; SMN2L3MBTL1
SCHEMBL20254703 0.72 DGAT1 (0.58) ALDH1A1DGAT1CA2SMN1; SMN2L3MBTL1
SCHEMBL20254517 0.72 DGAT1 (0.58) ALDH1A1DGAT1CA2L3MBTL1
SCHEMBL6787910 0.72 CA2 (0.75) ALDH1A1CA2SMN1; SMN2L3MBTL1
SCHEMBL5537767 0.72 CA2 (0.75) ALDH1A1CA2SMN1; SMN2L3MBTL1
SCHEMBL4887329 0.71 CA2 (0.48) ALDH1A1DGAT1CA2SMN1; SMN2L3MBTL1

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-20080200512-A1 Hepatitis C virus polymerase inhibitors BLANEY JEFFREY MARK 2008-08-21 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-20080200512-A1 Hepatitis C virus polymerase inhibitors SSU72, POLR2H, POLR2E ALDH1A1 276/4885DGAT1 1581/4885CA2 1113/4885

“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.