SCHEMBL4975775

SCHEMBL4975775

Cc1cc(Cl)cc2c(=O)oc(-c3cc(Br)nn3-c3c(Cl)ccc[n+]3[O-])nc12

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.33
▸ POLB P06746 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.33

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
SCHEMBL4163531 0.83 ALDH1A1 (0.34) ALDH1A1POLBMAPTNPSR1
SCHEMBL29598524 0.81 DHODH (0.43) ALDH1A1POLBMAPTNPSR1
SCHEMBL465839 0.81 DHODH (0.43) ALDH1A1POLBMAPTNPSR1
SCHEMBL31060078 0.79 PDE4A (0.31) —
SCHEMBL4975983 0.79 DHODH (0.31) —
SCHEMBL28531289 0.77 DHODH (0.41) ALDH1A1POLBMAPTNPSR1
SCHEMBL29215063 0.77 DHODH (0.36) MAPT
SCHEMBL4976959 0.77 DHODH (0.33) —
SCHEMBL15984460 0.77 DHODH (0.33) MAPT
SCHEMBL29791544 0.77 DHODH (0.33) MAPT

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
US-7339057-B2 Method for preparing fused oxazinones from ortho-amino aromatic carboxylic acid and carboxylic acid in the presence of a sulfonyl chloride and pyridine E.I. DU PONT DE NEMOURS AND COMPANY (US) 2008-03-04 — — US disclosed
EP-1549643-B1 METHOD FOR PREPARING FUSED OXAZINONES FROM ORTHO-AMINO AROMATIC CARBOXYLIC ACID AND A CARBOXYLIC ACID IN THE PRESENCE OF A SULFONYL CHLORIDE AND PYRIDINE DU PONT (US) 2007-08-29 — — EP disclosed
US-20050215785-A1 Method for preparing fused oxazinones from ortho-amino aromatic carboxylic acid and carboxylic acid in the presence of a sulfonyl chloride and pyridine FMC CORPORATION 2005-09-29 — — US 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-20050215785-A1 Method for preparing fused oxazinones from ortho-amino aromatic carboxylic acid and carboxylic acid in the presence of a sulfonyl chloride and pyridine OXGR1, OXSR1, OXER1 ALDH1A1 823/4885POLB 4779/4885MAPT 4755/4885

“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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