SCHEMBL3574693

SCHEMBL3574693

C=CCOC[C@H](NC(=O)O)[C@H]1CO1

nearest known ligand 0.39

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.39
CA1 P00915 2/20 0.34
CA2 P00918 2/20 0.34
CA7 P43166 1/20 0.34
CA9 Q16790 1/20 0.32

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
SCHEMBL26667262 0.73 CA1 (0.42) CA1CA2CA7CA9
SCHEMBL3241686 0.71
SCHEMBL3570194 0.71
SCHEMBL15054412 0.70 CA1 (0.40) ALDH1A1CA1CA2CA7CA9
SCHEMBL22405499 0.70 CA1 (0.40) ALDH1A1CA1CA2CA7CA9
SCHEMBL22406008 0.70 CA1 (0.40) ALDH1A1CA1CA2CA7CA9
SCHEMBL2175005 0.68
SCHEMBL2175003 0.68 ALDH1A1 (0.34) ALDH1A1CA1CA2CA7
SCHEMBL4436363 0.67 CPA1 (0.38) ALDH1A1
SCHEMBL4436371 0.67 CPA1 (0.38) ALDH1A1

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-7745484-B2 Beta-secretase modulators and methods of use AMGEN INC. (US) 2010-06-29 US disclosed
US-20070185144-A1 Beta-secretase modulators and methods of use AMGEN INC. (US) 2007-08-09 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-20070185144-A1 Beta-secretase modulators and methods of use BACE1, BACE2, APP ALDH1A1 2461/4885CA1 290/4885CA2 1594/4885

“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.