SCHEMBL10195165

SCHEMBL10195165

CCc1ccc(Oc2ncc(C(F)(F)F)cc2F)cc1C1=C(O)C(C)(C)OC(C)(C)C1=O

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 1/20 0.37
RAB9A P51151 1/20 0.37
LMNA P02545 3/20 0.35
SMN1; SMN2 Q16637 4/20 0.35
ALDH1A1 P00352 2/20 0.34
FFAR1 O14842 2/20 0.33
HCRTR1 O43613 4/20 0.32
LIPE Q05469 1/20 0.32
PTGS2 P35354 1/20 0.32
PPARG P37231 1/20 0.32

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
SCHEMBL10195267 0.91 RAB9A (0.37) RAB9ALMNASMN1; SMN2ALDH1A1FFAR1
SCHEMBL10195140 0.90 RAB9A (0.49) RAB9ALMNASMN1; SMN2ALDH1A1FFAR1
SCHEMBL13286530 0.88 PPARG (0.37) PPARG
SCHEMBL10195148 0.87 PPARG (0.38) LMNASMN1; SMN2LIPEPPARG
SCHEMBL10195346 0.86 FFAR1 (0.34) FFAR1
SCHEMBL16180990 0.86 RAB9A (0.34) RAB9ALMNASMN1; SMN2
SCHEMBL10195117 0.85 MAPK1 (0.45) SCN9ARAB9ALMNALIPE
SCHEMBL10192920 0.84 RAB9A (0.50) RAB9ALMNASMN1; SMN2ALDH1A1FFAR1
SCHEMBL10195200 0.84 MMP14 (0.35) RAB9AFFAR1PPARG
SCHEMBL10195261 0.83 MAPK1 (0.34) SCN9ARAB9ALMNASMN1; SMN2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2387569-B1 HERBCIDES SYNGENTA LTD (GB) 2016-06-15 EP disclosed
US-20140378305-A1 NOVEL HERBICIDES SYNGENTA LIMITED (GB) 2014-12-25 US disclosed
US-20140378305-A1 NOVEL HERBICIDES SYNGENTA LIMITED (GB) 2014-12-25 US disclosed
US-8865623-B2 Herbicidally active cyclic diones and derivatives thereof, processes for their preparation, compositions, and method of controlling weeds SYNGENTA LIMITED (GB) 2014-10-21 US disclosed
US-8865623-B2 Herbicidally active cyclic diones and derivatives thereof, processes for their preparation, compositions, and method of controlling weeds SYNGENTA LIMITED (GB) 2014-10-21 US disclosed
US-20120021907-A1 NOVEL HERBICIDES SYNGENTA CROP PROTECTION LLC (US) 2012-01-26 US disclosed
US-20120021907-A1 NOVEL HERBICIDES SYNGENTA CROP PROTECTION LLC (US) 2012-01-26 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 (2 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-20140378305-A1 NOVEL HERBICIDES DDT, CYP4X1, CYP1B1 SCN9A 1880/4885RAB9A 2665/4885LMNA 4151/4885
US-20120021907-A1 NOVEL HERBICIDES DDT, CYP4X1, CYP1B1 SCN9A 2224/4885RAB9A 3044/4885LMNA 4657/4885

“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.