SCHEMBL13515992

SCHEMBL13515992

O=C(Nc1c(Cl)cc(C(F)(C(F)(F)F)C(F)(F)Br)cc1S(=O)(=O)C(F)F)c1ccc2ccc[n+]([O-])c2c1

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ KCNJ11 Q14654 7/20 0.35
▸ ALDH1A1 P00352 2/20 0.32
▸ ABCC9 O60706 3/20 0.32
▸ ABCC8 Q09428 3/20 0.32
▸ KCNJ8 Q15842 3/20 0.32
▸ GAA P10253 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ TP53 P04637 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ HSD17B10 Q99714 1/20 0.31
▸ ENPP3 O14638 1/20 0.30
▸ ENPP1 P22413 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
SCHEMBL13516495 0.96 KCNJ11 (0.36) KCNJ11ALDH1A1ABCC9ABCC8KCNJ8
SCHEMBL13516372 0.93 KCNJ11 (0.35) KCNJ11ALDH1A1ABCC9ABCC8KCNJ8
SCHEMBL13516066 0.91 KCNJ11 (0.32) KCNJ11ABCC9ABCC8KCNJ8ENPP3
SCHEMBL13515943 0.90 KCNJ11 (0.31) KCNJ11ABCC9ABCC8KCNJ8TP53
SCHEMBL13516091 0.90 KCNJ11 (0.36) KCNJ11ALDH1A1ABCC9ABCC8KCNJ8
SCHEMBL13516001 0.87 KCNJ11 (0.33) KCNJ11ABCC9ABCC8KCNJ8ENPP3
SCHEMBL13515991 0.86 HTT (0.33) KCNJ11ABCC9ABCC8KCNJ8TP53
SCHEMBL13515939 0.85 KCNJ11 (0.38) KCNJ11ALDH1A1ABCC9ABCC8KCNJ8
SCHEMBL13516028 0.85 KCNJ11 (0.41) KCNJ11ABCC9ABCC8KCNJ8
SCHEMBL13516096 0.85 KCNJ11 (0.32) KCNJ11ENPP3ENPP1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2456759-B1 PESTICIDAL CARBOXAMIDES BAYER CROPSCIENCE AG (DE) 2017-04-19 — — EP disclosed
US-8822691-B2 Pesticidal carboxamides BAYER CROPSCIENCE AG (DE) 2014-09-02 — — US disclosed
US-20120277185-A1 Pesticidal Carboxamides BAYER CROPSCIENDE AG (DE) 2012-11-01 — — 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-20120277185-A1 Pesticidal Carboxamides DDT, ACHE, AADAC KCNJ11 2296/4885ALDH1A1 1266/4885ABCC9 1634/4885

“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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