SCHEMBL1831264

SCHEMBL1831264

Cc1cc(Cn2nc(C(F)(F)F)nc2C(F)(F)F)ccc1[N+](=O)[O-]

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
DCTPP1 Q9H773 1/20 0.36
HTT P42858 2/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
HPGD P15428 2/20 0.35
MAPT P10636 1/20 0.35
LMNA P02545 1/20 0.35
GAA P10253 1/20 0.35
TSHR P16473 1/20 0.35
NR3C1 P04150 1/20 0.34
PGR P06401 1/20 0.34
AR P10275 1/20 0.34
CYP19A1 P11511 1/20 0.34
HSD17B10 Q99714 1/20 0.34
BLM P54132 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
POLB P06746 1/20 0.33
PTGDR2 Q9Y5Y4 1/20 0.33
ALDH1A1 P00352 1/20 0.33

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
SCHEMBL1832339 0.92 HPGD (0.36) DCTPP1HTTKMT2AHPGDMAPT
SCHEMBL1833620 0.92 DCTPP1 (0.37) DCTPP1HTTMEN1KMT2AHPGD
SCHEMBL1833080 0.92 HPGD (0.34) DCTPP1HTTMEN1KMT2AHPGD
SCHEMBL1836419 0.92 DCTPP1 (0.35) DCTPP1HTTMEN1KMT2AHPGD
SCHEMBL13335217 0.91 DCTPP1 (0.38) DCTPP1HTTMEN1KMT2AHPGD
SCHEMBL12402756 0.90 HTT (0.33) DCTPP1HTTMEN1KMT2AHPGD
SCHEMBL12402750 0.90 DCTPP1 (0.34) DCTPP1HTTMEN1KMT2AHPGD
SCHEMBL1833287 0.86 HPGD (0.34) HTTMEN1KMT2AHPGDMAPT
SCHEMBL1833115 0.85 HPGD (0.34) HTTMEN1KMT2AHPGDMAPT
SCHEMBL1834046 0.85 HPGD (0.34) HTTMEN1KMT2AHPGDMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110184188-A1 Insecticidal Benzenedicarboxamide Derivative BAYER CROPSCIENCE AG (DE) 2011-07-28 US disclosed
US-20110184188-A1 Insecticidal Benzenedicarboxamide Derivative BAYER CROPSCIENCE AG (DE) 2011-07-28 US disclosed
EP-2318374-A2 INSECTICIDAL BENZENEDICARBOXAMIDE DERIVATIVE Bayer CropScience AG (DE) 2011-05-11 EP disclosed
WO-2010012442-A2 INSECTICIDAL BENZENEDICARBOXAMIDE DERIVATIVE BAYER CROPSCIENCE AG (DE) 2010-02-04 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-20110184188-A1 Insecticidal Benzenedicarboxamide Derivative DDT, BRD9, BCL2A1 DCTPP1 4527/4885HTT 3414/4885MEN1 4180/4885

“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.