SCHEMBL2184189

SCHEMBL2184189

Cc1cc(C(C=O)n2nc(C(F)(F)F)cc2C(F)(F)F)ccc1[N+](=O)[O-]

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.33
GAA P10253 1/20 0.33
HPGD P15428 1/20 0.33
TSHR P16473 1/20 0.33
POLB P06746 1/20 0.32
TRPC3 Q13507 1/20 0.31
AR P10275 1/20 0.31
ALDH1A1 P00352 2/20 0.31
PTGS1 P23219 1/20 0.31
KDM4E B2RXH2 1/20 0.31
SIRT6 Q8N6T7 1/20 0.30
LMNA P02545 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
SCHEMBL1835101 0.79 SMN1; SMN2 (0.36) MAPTGAATSHRPOLBALDH1A1
SCHEMBL1831803 0.73 TRPC3 (0.50) GAAHPGDTSHRTRPC3PTGS1
SCHEMBL2889605 0.71 MAPT (0.37) MAPTGAAHPGDTSHRPOLB
SCHEMBL12402804 0.71 MAPT (0.37) MAPTGAAHPGDTSHRPOLB
SCHEMBL1833356 0.70 GRIA2 (0.46) MAPTGAAHPGDTSHRPOLB
SCHEMBL1834025 0.67 TSHR (0.46) MAPTGAATSHRPOLBALDH1A1
SCHEMBL12402474 0.67 HPGD (0.47) MAPTGAAHPGDTSHRPOLB
SCHEMBL12614866 0.66 MAPT (0.46) MAPTHPGDTSHRPOLBALDH1A1
SCHEMBL12614895 0.66 MAPT (0.46) MAPTHPGDTSHRPOLBALDH1A1
SCHEMBL2891803 0.66 HPGD (0.43) MAPTGAAHPGDTSHRTRPC3

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-20110184188-A1 Insecticidal Benzenedicarboxamide Derivative BAYER CROPSCIENCE AG (DE) 2011-07-28 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-20110184188-A1 Insecticidal Benzenedicarboxamide Derivative DDT, BRD9, BCL2A1 MAPT 4079/4885GAA 4457/4885HPGD 2921/4885

“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.