SCHEMBL7533404

SCHEMBL7533404

C=CCOC(=O)N1CCc2[nH]cnc2C1Cc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
AOC3 Q16853 3/20 0.51
CYP19A1 P11511 1/20 0.37
PSEN1 P49768 1/20 0.37
PSEN2 P49810 1/20 0.37
APH1B Q8WW43 1/20 0.37
NCSTN Q92542 1/20 0.37
APH1A Q96BI3 1/20 0.37
PSENEN Q9NZ42 1/20 0.37
FAAH O00519 3/20 0.36
MGLL Q99685 1/20 0.36
ELANE P08246 3/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
PTGDR2 Q9Y5Y4 1/20 0.34
F2 P00734 2/20 0.34
CHRM1 P11229 1/20 0.34
CTSG P08311 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34

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
SCHEMBL7527574 0.88 AOC3 (0.57) AOC3PSEN1PSEN2APH1BNCSTN
SCHEMBL7528650 0.84 AOC3 (0.51) AOC3PSEN1PSEN2APH1BNCSTN
SCHEMBL7527428 0.83 AOC3 (0.47) AOC3CYP19A1MEN1KMT2ACHRM1
SCHEMBL7568713 0.83 AOC3 (0.49) AOC3PSEN1PSEN2APH1BNCSTN
SCHEMBL7534038 0.80 AOC3 (0.49) AOC3CYP19A1FAAHMGLLMEN1
Hydrochloric Acid SCHEMBL11490292 0.78 AOC3 (0.58) AOC3PSEN1PSEN2APH1BNCSTN
Trifluoroacetic Acid SCHEMBL7528873 0.74 AOC3 (0.52) AOC3FAAHMEN1KMT2APTGDR2
Trifluoroacetic Acid SCHEMBL7529674 0.74 AOC3 (0.54) AOC3MEN1KMT2APTGDR2
SCHEMBL7529041 0.74 AOC3 (0.61) AOC3
SCHEMBL1971755 0.71 AOC3 (0.80) AOC3PTGDR2

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 1/4885CYP19A1 338/4885PSEN1 2429/4885

“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.