SCHEMBL10195117

SCHEMBL10195117

CCc1ccc(Oc2ccc(C(F)(F)F)cn2)cc1C1=C(O)C(C)(C)OC(C)(C)C1=O

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.45
LMNA P02545 1/20 0.42
THRB P10828 1/20 0.41
SCN9A Q15858 13/20 0.41
SCN10A Q9Y5Y9 1/20 0.41
MAPT P10636 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
RAB9A P51151 1/20 0.40
LIPE Q05469 1/20 0.39

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
SCHEMBL10192850 0.94 MAPK1 (0.46) MAPK1LMNATHRBSCN9ASCN10A
SCHEMBL10195200 0.87 MMP14 (0.35) THRBRAB9A
SCHEMBL10195272 0.87 NPC1 (0.38) MAPK1SCN9ARAB9A
SCHEMBL10195284 0.87 PDE4B (0.30)
SCHEMBL10195266 0.86 PPARG (0.35) LMNASCN9AMAPTNPSR1RAB9A
SCHEMBL10195267 0.85 RAB9A (0.37) LMNARAB9ALIPE
SCHEMBL10195165 0.85 SCN9A (0.37) LMNASCN9ARAB9ALIPE
SCHEMBL10195140 0.85 RAB9A (0.49) LMNAMAPTRAB9ALIPE
SCHEMBL10195265 0.84 PTDSS1 (0.35) RAB9A
SCHEMBL10195269 0.83 PDE4B (0.41) SCN9A

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 8 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
WO-2010081755-A1 NOVEL HERBICIDES SYNGENTA LIMITED (GB) 2010-07-22 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 (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 MAPK1 2927/4885LMNA 4151/4885THRB 1628/4885
US-20120021907-A1 NOVEL HERBICIDES DDT, CYP4X1, CYP1B1 MAPK1 2263/4885LMNA 4657/4885THRB 1157/4885

“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.