SCHEMBL6683080

SCHEMBL6683080

CC(C)C(=O)Nc1c(Cl)cccc1C(=O)Nc1ccc(OC(F)(F)F)cc1

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.56
MAPT P10636 3/20 0.53
PTGS2 P35354 1/20 0.51
ABL1 P00519 1/20 0.47
TRPV1 Q8NER1 3/20 0.47
MEN1 O00255 4/20 0.47
KMT2A Q03164 4/20 0.47
NPC1 O15118 1/20 0.47
XBP1 P17861 1/20 0.47
EPHX2 P34913 1/20 0.46
CHRNA7 P36544 1/20 0.45
HTT P42858 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
ALDH1A1 P00352 1/20 0.45
PNLIP P16233 1/20 0.44

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
SCHEMBL6683082 0.83 TDP1 (0.50) TDP1MAPTPTGS2ABL1TRPV1
SCHEMBL171565 0.79 EPHX2 (0.67) MAPTTRPV1MEN1KMT2AEPHX2
SCHEMBL6716560 0.79 TDP1 (0.62) TDP1MAPTPTGS2ABL1TRPV1
SCHEMBL6713049 0.75 TDP1 (0.58) TDP1MAPTPTGS2ABL1TRPV1
SCHEMBL1496356 0.73 TRPV1 (0.59) TDP1MAPTABL1TRPV1NPC1
SCHEMBL12225782 0.73 NPC1 (0.69) TDP1MAPTTRPV1MEN1KMT2A
SCHEMBL18855245 0.72 PTGS2 (0.52) TDP1MAPTPTGS2TRPV1MEN1
SCHEMBL5176800 0.72 TSHR (0.49) MAPTPTGS2MEN1KMT2ANPC1
SCHEMBL4423725 0.72 ALDH1A1 (0.52) TDP1MAPTPTGS2ABL1TRPV1
SCHEMBL24823651 0.72 ABL1 (0.47) TDP1MAPTABL1TRPV1MEN1

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-20040235959-A1 Insecticidal diamides E. I. DU PONT DE NEMOURS AND COMPANY 2004-11-25 US disclosed
EP-1427705-A2 INSECTICIDAL DIAMIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 2004-06-16 EP disclosed
WO-2003026415-A2 INSECTICIDAL DIAMIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 2003-04-03 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-20040235959-A1 Insecticidal diamides DDT, NRDC, NOXO1 TDP1 2624/4885MAPT 4447/4885PTGS2 1234/4885

“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.