SCHEMBL21889045

SCHEMBL21889045

NC/C(=C\F)COc1ccc(N2C(=O)C(=O)c3ccccc32)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ AOC3 Q16853 13/20 1.00
▸ AOC2 O75106 7/20 0.54
▸ MAOA P21397 4/20 0.54
▸ MAOB P27338 3/20 0.54
▸ DAO P14920 2/20 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
SCHEMBL21889295 0.79 AOC3 (0.65) AOC3AOC2MAOB
SCHEMBL4803974 0.73 ALDH1A1 (0.62) AOC3
SCHEMBL13985405 0.73 CES1 (0.58) AOC3
SCHEMBL10615836 0.72 MAOB (1.00) AOC3AOC2MAOAMAOBDAO
SCHEMBL3506282 0.72 MAOB (1.00) AOC3AOC2MAOAMAOBDAO
SCHEMBL3506284 0.72 MAOB (1.00) AOC3AOC2MAOAMAOBDAO
SCHEMBL4185409 0.71 AOC3 (0.56) AOC3
SCHEMBL23718739 0.70 AOC2 (0.81) AOC3AOC2MAOAMAOBDAO
SCHEMBL23718741 0.70 AOC2 (0.81) AOC3AOC2MAOAMAOBDAO
SCHEMBL3047148 0.70 ALDH1A1 (0.67) AOC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3626699-B1 SSAO INHIBITOR SHANDONG DANHONG PHARMACEUTICAL CO LTD (CN) 2023-07-12 — — EP disclosed
US-20210198220-A1 SSAO INHIBITOR SHANDONG DANHONG PHARMACEUTICAL CO LTD (CN) 2021-07-01 — — US disclosed
US-11001563-B2 SSAO inhibitor SHANDONG DANHONG PHARMACEUTICAL CO LTD (CN) 2021-05-11 — — US disclosed
US-20200115352-A1 SSAO INHIBITOR SHANDONG DANHONG PHARMACEUTICAL CO., LTD. 2020-04-16 — — US disclosed
EP-3626699-A1 SSAO INHIBITOR Shandong Danhong Pharmaceutical Co., Ltd. (CN) 2020-03-25 — — EP 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 (3 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-11001563-B2 SSAO inhibitor SSB, ASAH2, AOX1 AOC3 53/4885AOC2 30/4885MAOA 74/4885
US-20210198220-A1 SSAO INHIBITOR SSB, ASAH2, AOX1 AOC3 53/4885AOC2 30/4885MAOA 74/4885
US-20200115352-A1 SSAO INHIBITOR SSB, ASAH2, AOX1 AOC3 53/4885AOC2 30/4885MAOA 74/4885

“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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