SCHEMBL7527633

SCHEMBL7527633

CCC1c2nc[nH]c2CCN1C(=O)OCC(Cl)(Cl)Cl

nearest known ligand 0.48

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
AOC3 Q16853 3/20 0.48
PTGDR2 Q9Y5Y4 1/20 0.32
MAPT P10636 1/20 0.30
KDM4E B2RXH2 1/20 0.30
RXFP1 Q9HBX9 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
SCHEMBL7528248 0.91 AOC3 (0.46) AOC3PTGDR2
SCHEMBL7528650 0.84 AOC3 (0.51) AOC3KDM4E
SCHEMBL1971904 0.83 AOC3 (0.68) AOC3
SCHEMBL7534337 0.83 AOC3 (0.56) AOC3PTGDR2MAPTKDM4ERXFP1
SCHEMBL7572011 0.80 AOC3 (0.43) AOC3
Hydrochloric Acid SCHEMBL11490292 0.80 AOC3 (0.58) AOC3KDM4E
Trifluoroacetic Acid SCHEMBL7530146 0.79 AOC3 (0.45) AOC3
Trifluoroacetic Acid SCHEMBL7529674 0.78 AOC3 (0.54) AOC3PTGDR2MAPTKDM4E
SCHEMBL7534329 0.78 AOC3 (0.48) AOC3
SCHEMBL11516165 0.76 AOC3 (0.43) AOC3MAPTKDM4E

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2002038153-A1 NEW USE OF 4, 5, 6, 7-TETRAHYDROIMIDAZO-[4,5-C]PYRIDINE DERIVATIVES BIOVITRUM AB (SE) 2002-05-16 WO claimed
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 1/4885PTGDR2 887/4885MAPT 4185/4885

“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.