SCHEMBL340962

SCHEMBL340962

O=C(O)Cc1c(Br)cc(OC(F)(F)F)cc1Br

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 4/20 0.43
ALDH1A1 P00352 1/20 0.43
POLB P06746 1/20 0.43
GAA P10253 1/20 0.43
EGLN1 Q9GZT9 1/20 0.38
PTGS2 P35354 2/20 0.37
PTGS1 P23219 1/20 0.37
CYP2C9 P11712 2/20 0.36
MRGPRX4 Q96LA9 1/20 0.35
FFAR1 O14842 3/20 0.35
FFAR4 Q5NUL3 3/20 0.35
AKR1C3 P42330 1/20 0.35
AKR1C2 P52895 1/20 0.35
EPHX2 P34913 1/20 0.35
AURKA O14965 1/20 0.35
TPX2 Q9ULW0 1/20 0.35
PIM1 P11309 1/20 0.35
THRA P10827 1/20 0.35
RXRA P19793 1/20 0.35
RXRB P28702 1/20 0.35

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
SCHEMBL10212137 0.79 AKR1B1 (0.47) THRBPTGS2PTGS1CYP2C9MRGPRX4
SCHEMBL508558 0.78 PTGS2 (0.47) POLBPTGS2PTGS1CYP2C9RXRA
SCHEMBL19475238 0.76 THRA (0.39) THRBALDH1A1PTGS2PTGS1CYP2C9
SCHEMBL15728088 0.73 RXRA (0.51) THRBALDH1A1POLBGAAPTGS1
SCHEMBL9658959 0.73 AKR1B1 (0.46) THRBAKR1C3AKR1C2AURKATHRA
SCHEMBL25460728 0.71 FFAR4 (0.49) THRBMRGPRX4FFAR1FFAR4THRA
SCHEMBL30057748 0.71 FFAR4 (0.49) THRBMRGPRX4FFAR1FFAR4THRA
SCHEMBL18528855 0.70 PKM (0.61) THRBALDH1A1POLBGAA
SCHEMBL30799387 0.70 AKR1B1 (0.38) FFAR4EPHX2RXRARXRBRXRG
SCHEMBL27034924 0.70 AKR1B1 (0.38) FFAR4EPHX2RXRARXRBRXRG

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
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
EP-2121597-B1 TRIFLUOROMETHOXYPHENYL-SUBSTITUTED TETRAMIC ACID DERIVATIVES AS PESTICIDES AND/OR HERBICIDES BAYER CROPSCIENCE AG (DE) 2011-09-21 EP disclosed
EP-2121597-A1 TRIFLUOROMETHOXYPHENYL-SUBSTITUTED TETRAMIC ACID DERIVATIVES AS PESTICIDES AND/OR HERBICIDES Bayer CropScience AG (DE) 2009-11-25 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 THRB 822/4885ALDH1A1 3990/4885POLB 1794/4885

“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.