SCHEMBL31060013

SCHEMBL31060013

COc1cc(-c2nc3c(Cl)cc(Br)cc3c(=O)o2)n(-c2ncccc2Cl)n1

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ DHODH Q02127 3/20 0.38
▸ KLK7 P49862 1/20 0.35
▸ KLK14 Q9P0G3 1/20 0.35
▸ KLK5 Q9Y337 1/20 0.35
▸ TP53 P04637 1/20 0.31
▸ MAPT P10636 1/20 0.30
▸ C1R P00736 1/20 0.30
▸ ELANE P08246 1/20 0.30
▸ RBP4 P02753 1/20 0.30

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
SCHEMBL15971327 0.94 RAB9A (0.38) DHODHKLK7KLK14KLK5TP53
SCHEMBL15971586 0.91 KLK7 (0.36) DHODHKLK7KLK14KLK5MAPT
SCHEMBL31060002 0.88 DHODH (0.37) DHODHKLK7KLK14KLK5MAPT
SCHEMBL31060019 0.86 DHODH (0.34) DHODHKLK7KLK14KLK5C1R
SCHEMBL25083045 0.85 DHODH (0.36) DHODHKLK7KLK14KLK5MAPT
SCHEMBL29215033 0.85 DHODH (0.36) DHODHKLK7KLK14KLK5MAPT
SCHEMBL31068039 0.85 DHODH (0.36) DHODHKLK7KLK14KLK5MAPT
SCHEMBL30234123 0.85 DHODH (0.36) DHODHKLK7KLK14KLK5MAPT
SCHEMBL12528630 0.84 DHODH (0.42) DHODHKLK7KLK14KLK5MAPT
SCHEMBL25283038 0.84 DHODH (0.36) DHODHKLK7KLK14KLK5MAPT

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-20240308988-A1 Method For Controlling Diamide Resistant Pests and Compounds Therefor SYNGENTA CROP PROTECTION AG (CH) 2024-09-19 — — 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-20240308988-A1 Method For Controlling Diamide Resistant Pests and Compounds Therefor DDT, NOS1, SLC11A2 DHODH 90/4885KLK7 3312/4885KLK14 3128/4885

“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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