SCHEMBL10212031

SCHEMBL10212031

CC1(C)NC(=O)C(c2c(Cl)cc(OC(F)(F)F)cc2Cl)=C1O

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.34
CES1 P23141 1/20 0.33
TGM2 P21980 1/20 0.33
AKR1C2 P52895 1/20 0.32
AKR1C1 Q04828 1/20 0.32
ACACB O00763 4/20 0.31
ACACA Q13085 4/20 0.31
BRAF P15056 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
SCHEMBL12325063 0.91 ABL1 (0.34) NOTUMACACBACACA
SCHEMBL10211985 0.91 DDR1 (0.31) NOTUM
SCHEMBL10212000 0.84 CES1 (0.33) CES1TGM2
SCHEMBL10211981 0.80 ACACB (0.39) NOTUMCES1ACACBACACA
SCHEMBL14189378 0.79 TGM2 (0.31) TGM2AKR1C2AKR1C1BRAF
SCHEMBL10212030 0.79 PDK2 (0.31) TGM2AKR1C2AKR1C1
SCHEMBL10267542 0.76 HCRTR1 (0.33) ACACBACACA
SCHEMBL10212009 0.76 FFAR4 (0.32) ACACBACACA
SCHEMBL10211989 0.73 MCHR1 (0.31)
SCHEMBL8280542 0.72 ACACB (0.54) ACACBACACA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8507537-B2 Trifluromethoxyphenyl-substituted tetramic acid derivatives pesticides and/or herbicides BAYER CROPSCIENCE AG (DE) 2013-08-13 US disclosed
US-8507537-B2 Trifluromethoxyphenyl-substituted tetramic acid derivatives pesticides and/or herbicides BAYER CROPSCIENCE AG (DE) 2013-08-13 US disclosed
US-20120015807-A1 Trifluromethoxyphenyl-Substituted Tetramic Acid Derivatives Pesticides and/or Herbicides BAYER CROPSCIENCE AG (DE) 2012-01-19 US disclosed
US-20120015807-A1 Trifluromethoxyphenyl-Substituted Tetramic Acid Derivatives Pesticides and/or Herbicides BAYER CROPSCIENCE AG (DE) 2012-01-19 US disclosed
EP-2121597-B1 TRIFLUOROMETHOXYPHENYL-SUBSTITUTED TETRAMIC ACID DERIVATIVES AS PESTICIDES AND/OR HERBICIDES BAYER CROPSCIENCE AG (DE) 2011-09-21 EP disclosed
WO-2008067873-A1 TRIFLUOROMETHOXYPHENYL-SUBSTITUTED TETRAMIC ACID DERIVATIVES AS PESTICIDES AND/OR HERBICIDES BAYER CROPSCIENCE AG (DE) 2008-06-12 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-20120015807-A1 Trifluromethoxyphenyl-Substituted Tetramic Acid Derivatives Pesticides and/or Herbicides DDT, PTPRG, SLC1A5 NOTUM 651/4885CES1 2170/4885TGM2 696/4885

“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.