SCHEMBL1832287

SCHEMBL1832287

Cc1cc(Cc2nc(C(F)(F)F)n(CC(F)(F)F)n2)ccc1[N+](=O)[O-]

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.35
HTT P42858 3/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
MAPT P10636 1/20 0.33
DCTPP1 Q9H773 1/20 0.33
HPGD P15428 2/20 0.33
NR3C1 P04150 1/20 0.33
PGR P06401 1/20 0.33
AR P10275 1/20 0.33
TSHR P16473 1/20 0.33
HSD17B10 Q99714 1/20 0.32
LMNA P02545 2/20 0.32
ALDH1A1 P00352 2/20 0.32
POLB P06746 1/20 0.32
MAPK1 P28482 1/20 0.31
CYP19A1 P11511 1/20 0.31
TXNRD1 Q16881 1/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 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
SCHEMBL1836269 0.90 GAA (0.36) GAAHTTMEN1KMT2AMAPT
SCHEMBL1831152 0.85 GAA (0.40) GAAHTTMEN1KMT2AMAPT
SCHEMBL1832766 0.83 GAA (0.35) GAAHTTMEN1KMT2AMAPT
SCHEMBL1832395 0.80 MAPT (0.33) GAAHTTMEN1KMT2AMAPT
SCHEMBL13335217 0.78 DCTPP1 (0.38) GAAHTTMEN1KMT2AMAPT
SCHEMBL1831884 0.77 POLB (0.33) GAAMAPTHPGDNR3C1PGR
SCHEMBL1830804 0.77 MAPT (0.39) GAAMAPTHPGDNR3C1PGR
SCHEMBL1831264 0.76 DCTPP1 (0.36) GAAHTTMEN1KMT2AMAPT
SCHEMBL1836419 0.74 DCTPP1 (0.35) GAAHTTMEN1KMT2AMAPT
SCHEMBL1833620 0.74 DCTPP1 (0.37) GAAHTTMEN1KMT2AMAPT

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
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 GAA 4457/4885HTT 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.