SCHEMBL31059985

SCHEMBL31059985

O=c1oc(-c2cc(I)nn2-c2ncccc2Cl)nc2c(Cl)cc(Cl)cc12

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ C1R P00736 3/20 0.34
▸ DHODH Q02127 2/20 0.31
▸ CTSG P08311 2/20 0.31
▸ KLK7 P49862 2/20 0.31
▸ KLK14 Q9P0G3 2/20 0.31
▸ KLK5 Q9Y337 2/20 0.31
▸ PRSS1 P07477 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.30
▸ POLB P06746 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ NPSR1 Q6W5P4 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
SCHEMBL950829 0.91 DHODH (0.35) C1RDHODHALDH1A1POLBMAPT
SCHEMBL31060019 0.90 DHODH (0.34) C1RDHODHCTSGKLK7KLK14
SCHEMBL30749778 0.88 DHODH (0.40) C1RDHODHCTSGKLK7KLK14
SCHEMBL950250 0.88 DHODH (0.40) C1RDHODHCTSGKLK7KLK14
SCHEMBL15972092 0.85 LIMK1 (0.33) C1RALDH1A1
SCHEMBL12528553 0.85 DHODH (0.35) C1RDHODHALDH1A1MAPTNPSR1
SCHEMBL15971586 0.85 KLK7 (0.36) C1RDHODHKLK7KLK14KLK5
SCHEMBL950826 0.85 KDM4E (0.36) C1RDHODHALDH1A1MAPT
SCHEMBL959093 0.85 C1R (0.33) C1RDHODHCTSGKLK7KLK14
SCHEMBL31060018 0.84 DHODH (0.37) C1RDHODH

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 C1R 2980/4885DHODH 90/4885CTSG 3503/4885

“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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