SCHEMBL11918013

SCHEMBL11918013

COc1c(Cl)ccc(-c2nc(C=O)c3c(C)c[nH]c3n2)c1F

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ MEP1B Q16820 1/20 0.33
▸ DYRK1A Q13627 1/20 0.32
▸ HSP90AB1 P08238 2/20 0.32
▸ HSP90AA1 P07900 1/20 0.31

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
SCHEMBL11913424 0.85 DYRK1A (0.35) MEP1BDYRK1AHSP90AB1HSP90AA1
SCHEMBL11918082 0.83 MEP1B (0.33) MEP1B
SCHEMBL1654718 0.82 TAS1R3 (0.34) MEP1BDYRK1AHSP90AB1
SCHEMBL1654720 0.82 KMO (0.41) MEP1BDYRK1AHSP90AB1
SCHEMBL11918078 0.80 ALOX5AP (0.31) MEP1B
SCHEMBL11903334 0.79 JAK3 (0.38) MEP1B
SCHEMBL11918060 0.78 MEP1B (0.33) MEP1B
SCHEMBL11902200 0.78 MEP1B (0.34) MEP1B
SCHEMBL11918041 0.78 TP53 (0.37) MEP1B
SCHEMBL12786015 0.77 EIF2AK3 (0.32) MEP1B

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-20120202690-A1 HERBICIDAL COMPOUNDS SYNGENTA LIMITED (US) 2012-08-09 — — 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-20120202690-A1 HERBICIDAL COMPOUNDS DDT, HAO2, HAAO MEP1B 2906/4885DYRK1A 520/4885HSP90AB1 607/4885

“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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