SCHEMBL7528894

SCHEMBL7528894

CCCC1c2nc[nH]c2CCN1C(=O)OC(C)OC

nearest known ligand 0.46

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
AOC3 Q16853 3/20 0.46
ALDH1A1 P00352 1/20 0.30
POLB P06746 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
SCHEMBL7534329 0.91 AOC3 (0.48) AOC3ALDH1A1POLB
SCHEMBL7528897 0.82 AOC3 (0.54) AOC3ALDH1A1POLB
SCHEMBL7571934 0.81 AOC3 (0.46) AOC3ALDH1A1POLB
Trifluoroacetic Acid SCHEMBL7525401 0.80 AOC3 (0.43) AOC3
SCHEMBL7527428 0.80 AOC3 (0.47) AOC3
SCHEMBL7528248 0.79 AOC3 (0.46) AOC3
SCHEMBL7527430 0.78 AOC3 (0.52) AOC3ALDH1A1POLB
Trifluoroacetic Acid SCHEMBL7530958 0.74 AOC3 (0.40) AOC3ALDH1A1
Trifluoroacetic Acid SCHEMBL7528189 0.73 AOC3 (0.43) AOC3ALDH1A1POLB
SCHEMBL7534337 0.73 AOC3 (0.56) AOC3ALDH1A1POLB

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-20020198189-A1 Treatment or prophylaxis of Semicarbazide-sensitive amine oxidase (SSAO) mediated complications in mammals including humans BIOVITRUM AB (SE) 2002-12-26 US disclosed
WO-2002038153-A1 NEW USE OF 4, 5, 6, 7-TETRAHYDROIMIDAZO-[4,5-C]PYRIDINE DERIVATIVES BIOVITRUM AB (SE) 2002-05-16 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-20020198189-A1 Treatment or prophylaxis of Semicarbazide-sensitive amine oxidase (SSAO) mediated complications in mammals including humans AOC3, AOC2, AOC1 AOC3 1/4885ALDH1A1 19/4885POLB 729/4885

“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.