SCHEMBL3374683

SCHEMBL3374683

Cc1cc(OC(F)(F)F)ccc1N1C(=O)c2cccc(OS(C)(=O)=O)c2C1=O

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
CHRM5 P08912 12/20 0.44
ALDH1A1 P00352 1/20 0.39
CCR9 P51686 1/20 0.38
SCN10A Q9Y5Y9 2/20 0.37
GRM1 Q13255 1/20 0.36
GRM4 Q14833 1/20 0.36

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
SCHEMBL3377842 0.91 LMNA (0.50) LMNASMN1; SMN2CHRM5ALDH1A1CCR9
SCHEMBL3377868 0.90 LMNA (0.49) LMNASMN1; SMN2CHRM5ALDH1A1CCR9
SCHEMBL3378400 0.86 LMNA (0.48) LMNASMN1; SMN2ALDH1A1CCR9GRM1
SCHEMBL3374479 0.84 LMNA (0.47) LMNASMN1; SMN2ALDH1A1GRM1GRM4
SCHEMBL3376357 0.84 LMNA (0.47) LMNASMN1; SMN2ALDH1A1GRM1GRM4
SCHEMBL3377234 0.84 CCR9 (0.48) LMNASMN1; SMN2ALDH1A1CCR9
SCHEMBL3373257 0.81 LMNA (0.47) LMNASMN1; SMN2CHRM5GRM1GRM4
SCHEMBL3374723 0.77 LMNA (0.47) LMNASMN1; SMN2ALDH1A1CCR9GRM1
SCHEMBL3377243 0.76 LMNA (0.47) LMNASMN1; SMN2ALDH1A1CCR9GRM1
SCHEMBL3375860 0.75 LMNA (0.46) LMNASMN1; SMN2ALDH1A1GRM1GRM4

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-1517886-B1 NOVEL PHTHALAMIDE DERIVATIVES BAYER CROPSCIENCE AG (DE) 2010-11-10 EP disclosed
US-7132455-B2 Phthalamide derivatives BAYER CROPSCIENCE AG (DE) 2006-11-07 US disclosed
US-20060035967-A1 Novel phthalamide derivatives BAYER INTELLECTUAL PROPERTY GMBH (DE) 2006-02-16 US disclosed
EP-1517886-A1 NOVEL PHTHALAMIDE DERIVATIVES Bayer CropScience AG (DE) 2005-03-30 EP disclosed
WO-2004000796-A1 NOVEL PHTHALAMIDE DERIVATIVES BAYER CROPSCIENCE AG (DE) 2003-12-31 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-20060035967-A1 Novel phthalamide derivatives HDAC1, HDAC2, CRY1 LMNA 3512/4885SMN1; SMN2 3786/4885CHRM5 3212/4885

“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.