SCHEMBL15086925

SCHEMBL15086925

CCCOP(C)(=O)ON1C(=O)c2ccccc2C1=O

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 1/20 0.44
▸ MEN1 O00255 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ ALDH1A1 P00352 3/20 0.43
▸ TDP1 Q9NUW8 1/20 0.40
▸ PKM P14618 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.38
▸ F2 P00734 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ VDR P11473 1/20 0.38

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
SCHEMBL19341904 0.83 GAA (0.46) GAAMEN1KMT2AALDH1A1KDM4E
SCHEMBL19341893 0.76 GAA (0.43) GAAALDH1A1TDP1KDM4EF2
SCHEMBL6625137 0.74 GAA (0.69) GAAMEN1KMT2AALDH1A1TDP1
SCHEMBL2596763 0.74 ALDH1A1 (0.41) GAAMEN1KMT2AALDH1A1TDP1
SCHEMBL19341908 0.72 GAA (0.48) GAAMEN1KMT2AALDH1A1KDM4E
SCHEMBL7109766 0.71 GAA (0.42) GAAALDH1A1MAPT
SCHEMBL24181345 0.69 GAA (0.83) GAAMEN1KMT2AALDH1A1TDP1
SCHEMBL16729201 0.69 GAA (0.83) GAAMEN1KMT2AALDH1A1TDP1
SCHEMBL14560518 0.68 TDP1 (0.76) GAAMEN1KMT2AALDH1A1TDP1
SCHEMBL10448207 0.68 ALDH1A1 (0.43) GAAALDH1A1TDP1KDM4EF2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130172393-A1 PHENOXYALKYL PYRIDINIUM OXIME THERAPEUTICS FOR TREATMENT OF ORGANOPHOSPHATE POISONING MISSISSIPPI STATE UNIVERSITY 2013-07-04 — — 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-20130172393-A1 PHENOXYALKYL PYRIDINIUM OXIME THERAPEUTICS FOR TREATMENT OF ORGANOPHOSPHATE POISONING PNPO, PLPBP, PDXK GAA 1631/4885MEN1 3175/4885KMT2A 1998/4885

“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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