SCHEMBL16552398

SCHEMBL16552398

CCN(C)[C@H](C)Cc1ccc(OCc2cccc(Cl)c2)cc1

nearest known ligand 0.73

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 16/20 0.73
▸ ALOX5 P09917 1/20 0.56
▸ MAOA P21397 3/20 0.54

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
SCHEMBL9627307 0.88 MAOB (0.71) MAOBALOX5MAOA
SCHEMBL17931599 0.86 MAOB (0.56) MAOBMAOA
SCHEMBL17931575 0.85 MAOB (0.70) MAOBMAOA
SCHEMBL17931574 0.85 MAOB (0.73) MAOBMAOA
SCHEMBL16552346 0.85 MAOB (1.00) MAOBALOX5MAOA
SCHEMBL17931591 0.85 MAOB (0.72) MAOBMAOA
SCHEMBL17931578 0.84 MAOB (0.71) MAOBMAOA
SCHEMBL17931577 0.82 MAOB (0.72) MAOBALOX5MAOA
SCHEMBL17931586 0.81 MAOB (0.74) MAOBMAOA
SCHEMBL17931573 0.81 MAOB (0.74) MAOBMAOA

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-20160207878-A1 MAO-B Selective Inhibitor Compounds, Pharmaceutical Compositions Thereof and Uses Thereof THE UNIVERSITY OF BRITISH COLUMBIA (CA) 2016-07-21 — — US disclosed
WO-2015027324-A1 MAO-B SELECTIVE INHIBITOR COMPOUNDS, PHARMACEUTICAL COMPOSITIONS THEREOF AND USES THEREOF THE UNIVERSITY OF BRITISH COLUMBIA (CA) 2015-03-05 — — 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-20160207878-A1 MAO-B Selective Inhibitor Compounds, Pharmaceutical Compositions Thereof and Uses Thereof MAOB, MAOA, COMT MAOB 1/4885ALOX5 444/4885MAOA 2/4885

“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.

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