SCHEMBL24925652

SCHEMBL24925652

CO/N=C(/C)c1cccc(Oc2nc(OC)cc(OC)n2)c1C(=O)O

nearest known ligand 0.81

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.48
CYP3A4 P08684 2/20 0.48
CYP2C9 P11712 2/20 0.48
CYP2C19 P33261 2/20 0.48
GAA P10253 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
ALDH1A1 P00352 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47

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
SCHEMBL117724 1.00 CYP1A2 (0.48) CYP1A2CYP3A4CYP2C9CYP2C19GAA
SCHEMBL4829807 1.00 CYP1A2 (0.48) CYP1A2CYP3A4CYP2C9CYP2C19GAA
SCHEMBL29568381 1.00 CYP1A2 (0.48) CYP1A2CYP3A4CYP2C9CYP2C19GAA
Bispyribac SCHEMBL5267344 0.99 CYP1A2 (0.47) CYP1A2CYP3A4CYP2C9CYP2C19GAA
Pyriminobac-Methyl SCHEMBL65714 0.90 ALDH1A1 (0.55) CYP1A2CYP3A4CYP2C9CYP2C19GAA
Pyriminobac-Methyl SCHEMBL29395183 0.90 ALDH1A1 (0.55) CYP1A2CYP3A4CYP2C9CYP2C19GAA
Pyriminobac-Methyl SCHEMBL65713 0.90 ALDH1A1 (0.55) CYP1A2CYP3A4CYP2C9CYP2C19GAA
Pyriminobac-Methyl SCHEMBL32679458 0.90 ALDH1A1 (0.55) CYP1A2CYP3A4CYP2C9CYP2C19GAA
Pyriminobac-Methyl SCHEMBL4451500 0.90 ALDH1A1 (0.55) CYP1A2CYP3A4CYP2C9CYP2C19GAA
SCHEMBL17022772 0.86 CYP1A2 (0.42) CYP1A2CYP3A4CYP2C9CYP2C19GAA

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
WO-2024031002-A1 (2,4-DICHLOROPHENOXY)ACETIC ACID ANALOGS CORTEVA AGRISCIENCE LLC (US) 2024-02-08 WO disclosed
US-20230022569-A1 COMPOSITIONS COMPRISING PYRIDINE CARBOXYLATE HERBICIDES WITH ACETOLACTATE SYNTHASE (ALS) INHIBITOR HERBICIDES CORTEVA AGRISCIENCE LLC (US) 2023-01-26 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-20230022569-A1 COMPOSITIONS COMPRISING PYRIDINE CARBOXYLATE HERBICIDES WITH ACETOLACTATE SYNTHASE (ALS) INHIBITOR HERBICIDES SOD1, ABAT, ME1 CYP1A2 574/4885CYP3A4 1156/4885CYP2C9 804/4885

“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.