SCHEMBL31060002

SCHEMBL31060002

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

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ DHODH Q02127 3/20 0.37
▸ MAPT P10636 2/20 0.33
▸ ELANE P08246 1/20 0.33
▸ RBP4 P02753 1/20 0.33
▸ KLK7 P49862 1/20 0.33
▸ KLK14 Q9P0G3 1/20 0.33
▸ KLK5 Q9Y337 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.31
▸ POLB P06746 1/20 0.31
▸ NPSR1 Q6W5P4 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
SCHEMBL15971327 0.93 RAB9A (0.38) DHODHMAPTELANERBP4KLK7
SCHEMBL15971586 0.92 KLK7 (0.36) DHODHMAPTELANERBP4KLK7
SCHEMBL950141 0.90 DHODH (0.39) DHODHMAPTALDH1A1POLBNPSR1
SCHEMBL31060013 0.88 DHODH (0.38) DHODHMAPTELANERBP4KLK7
SCHEMBL28525374 0.87 DHODH (0.38) DHODHMAPTALDH1A1POLBNPSR1
SCHEMBL951422 0.86 DHODH (0.45) DHODHMAPTELANERBP4KLK7
SCHEMBL28500503 0.85 KDM4E (0.31) ALDH1A1
SCHEMBL25083045 0.84 DHODH (0.36) DHODHMAPTELANEKLK7KLK14
SCHEMBL31068039 0.84 DHODH (0.36) DHODHMAPTELANEKLK7KLK14
SCHEMBL30234123 0.84 DHODH (0.36) DHODHMAPTELANEKLK7KLK14

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 90/4885MAPT 594/4885ELANE 4798/4885

“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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