SCHEMBL123597

SCHEMBL123597

C/C=C/c1nc2nc(C(F)(F)F)c(C(=O)O)cc2cc1F

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GFER P55789 1/20 0.34
RXRA P19793 1/20 0.33
KEAP1 Q14145 1/20 0.31
NFE2L2 Q16236 1/20 0.31
NOTUM Q6P988 1/20 0.30
PPARA Q07869 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
SCHEMBL123598 1.00 GFER (0.34) GFERRXRAKEAP1NFE2L2NOTUM
SCHEMBL125518 0.84 PIM1 (0.38) GFERPPARA
SCHEMBL125483 0.84 PIM1 (0.38) GFERPPARA
SCHEMBL124546 0.83 KDM4E (0.46)
SCHEMBL126280 0.80 GFER (0.43) GFERRXRAKEAP1NFE2L2NOTUM
SCHEMBL126379 0.80 GFER (0.38) GFERKEAP1NFE2L2NOTUM
SCHEMBL28008303 0.77 GFER (0.36) GFERKEAP1NFE2L2NOTUM
SCHEMBL123860 0.76 PTPN1 (0.37) GFERKEAP1NFE2L2NOTUM
SCHEMBL124476 0.76 GFER (0.36) GFERKEAP1NFE2L2NOTUM
SCHEMBL125573 0.76 GFER (0.36) GFERKEAP1NFE2L2NOTUMPPARA

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-8461083-B2 Herbicidal compounds SYNGENTA LIMITED (GB) 2013-06-11 US disclosed
EP-2265120-B1 HERBICIDAL COUMPOUNDS SYNGENTA LTD (GB) 2012-03-07 EP disclosed
US-20110021352-A1 HERBICIDAL COMPOUNDS SYNGENTA CROP PROTECTION, INC. (US) 2011-01-27 US disclosed
EP-2265120-A1 HERBICIDAL COUMPOUNDS Syngenta Limited (GB) 2010-12-29 EP disclosed
WO-2009115788-A1 HERBICIDAL COUMPOUNDS SYNGENTA LIMITED (GB) 2009-09-24 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-20110021352-A1 HERBICIDAL COMPOUNDS RDX, NQO2, DDT GFER 986/4885RXRA 1619/4885KEAP1 200/4885

“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.