SCHEMBL11918004

SCHEMBL11918004

COc1c(Cl)ccc(-c2nc(C=O)c3c(n2)NC(c2ccccc2)C(c2ccccc2)N3)c1F

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ NOS1 P29475 1/20 0.34
▸ KIF11 P52732 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
SCHEMBL11918050 0.86 MEP1B (0.31) —
SCHEMBL11903070 0.85 NOS1 (0.35) NOS1KIF11
SCHEMBL11902671 0.83 NOS1 (0.36) NOS1KIF11
SCHEMBL11918073 0.81 TAS1R3 (0.31) —
SCHEMBL11903420 0.72 ALDH1A1 (0.37) —
SCHEMBL13256089 0.71 DHPS (0.36) —
SCHEMBL21584443 0.70 MEP1B (0.36) —
SCHEMBL11918041 0.70 TP53 (0.37) —
SCHEMBL11918001 0.70 ALOX5AP (0.31) —
SCHEMBL11903434 0.69 TAS1R3 (0.34) —

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 NOS1 780/4885KIF11 3664/4885

“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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