SCHEMBL997992

SCHEMBL997992

O=C(Nc1c(Cl)cc(C(F)(C(F)(F)F)C(F)(F)F)cc1SC(F)(F)F)c1ccc2ccc[n+]([O-])c2c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNJ11 Q14654 12/20 0.38
ABCC9 O60706 4/20 0.34
ABCC8 Q09428 4/20 0.34
KCNJ8 Q15842 4/20 0.34
CYP3A4 P08684 1/20 0.32
CYP2C9 P11712 1/20 0.32
TLR7 Q9NYK1 1/20 0.32
TAS1R3 Q7RTX0 1/20 0.32
TAS1R1 Q7RTX1 1/20 0.32
TAS1R2 Q8TE23 1/20 0.32
GAA P10253 1/20 0.32
MEN1 O00255 1/20 0.31
LMNA P02545 1/20 0.31
POLB P06746 1/20 0.31
MAPT P10636 1/20 0.31
XBP1 P17861 1/20 0.31
MAPK1 P28482 1/20 0.31
KMT2A Q03164 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
KCNK2 O95069 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
SCHEMBL18726199 0.96 KCNJ11 (0.36) KCNJ11ABCC9ABCC8KCNJ8CYP3A4
SCHEMBL13516064 0.96 KCNJ11 (0.36) KCNJ11ABCC9ABCC8KCNJ8CYP3A4
SCHEMBL13516071 0.89 KCNJ11 (0.37) KCNJ11ABCC9ABCC8KCNJ8TAS1R3
SCHEMBL13516116 0.89 KCNJ11 (0.34) KCNJ11ABCC9ABCC8KCNJ8KCNK2
SCHEMBL13516042 0.89 KCNJ11 (0.34) KCNJ11ABCC9ABCC8KCNJ8KCNK2
SCHEMBL13516030 0.87 KCNJ11 (0.42) KCNJ11ABCC9ABCC8KCNJ8TAS1R3
SCHEMBL13515969 0.86 KCNJ11 (0.33) KCNJ11ABCC9ABCC8KCNJ8KCNK2
SCHEMBL998320 0.85 KCNJ11 (0.35) KCNJ11ABCC9ABCC8KCNJ8TAS1R3
SCHEMBL13516224 0.85 KCNJ11 (0.35) KCNJ11ABCC9ABCC8KCNJ8TAS1R3
SCHEMBL13516376 0.85 KCNJ11 (0.33) KCNJ11

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 5 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
EP-2456759-A2 PESTICIDAL CARBOXAMIDES Bayer CropScience AG (DE) 2012-05-30 EP disclosed
WO-2011009540-A2 PESTICIDAL CARBOXAMIDES BAYER CROPSCIENCE AG (DE) 2011-01-27 WO 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 2296/4885ABCC9 1634/4885ABCC8 1760/4885

“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.