SCHEMBL7226294

SCHEMBL7226294

Cn1c(C(F)(F)F)cc(=O)n(-c2cc(Oc3ccc(OCC(=O)O)cc3)c(Cl)cc2F)c1=O

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 2/20 0.38
PPARD Q03181 3/20 0.37
MCL1 Q07820 1/20 0.35
BRAF P15056 2/20 0.35
PKM P14618 1/20 0.35
BCAT2 O15382 1/20 0.35
BCAT1 P54687 1/20 0.35
ADORA2A P29274 1/20 0.34
ADORA2B P29275 1/20 0.34
CYP2C19 P33261 1/20 0.34
HIF1A Q16665 2/20 0.34
PPARA Q07869 3/20 0.33
PPARG P37231 2/20 0.33
HTT P42858 1/20 0.33
NR4A1 P22736 1/20 0.33
APEX1 P27695 1/20 0.33
RORC P51449 1/20 0.33

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
SCHEMBL7233936 0.92 LMNA (0.37) FFAR1PPARDMCL1PKMBCAT2
SCHEMBL10577900 0.90 PKM (0.40) PPARDPKMCYP2C19HTTRORC
SCHEMBL29452779 0.88 BCAT1 (0.39) PKMBCAT2BCAT1CYP2C19RORC
SCHEMBL3245244 0.88 BCAT1 (0.39) PKMBCAT2BCAT1CYP2C19RORC
SCHEMBL27047534 0.87 LMNA (0.41) PKMBCAT2BCAT1CYP2C19HIF1A
SCHEMBL7226775 0.87 BCAT1 (0.36) FFAR1BRAFBCAT2BCAT1
SCHEMBL7237202 0.86 TRIM24 (0.39) PKMBCAT2BCAT1
SCHEMBL27047504 0.86 BCAT1 (0.37) PKMBCAT2BCAT1CYP2C19HIF1A
SCHEMBL27047553 0.85 PTGDR2 (0.37) PPARDPKMCYP2C19HTTRORC
SCHEMBL27047567 0.85 PTGDR2 (0.43) FFAR1BCAT2BCAT1CYP2C19RORC

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-6667413-B2 Aniline derivatives; herbicides; nonphytotoxic SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2003-12-23 US disclosed
US-20030130124-A1 Herbicides SUMITOMO CHEMICAL COMPANY, LIMITED 2003-07-10 US disclosed
US-6451740-B2 HERBICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-09-17 US disclosed
US-20020013466-A1 Uracil compounds and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-01-31 US disclosed
EP-1106607-A2 Uracil compounds and their use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-06-13 EP 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-20030130124-A1 Herbicides CBR3, CBR1, MT-CO1 FFAR1 2067/4885PPARD 1620/4885MCL1 232/4885
US-20020013466-A1 Uracil compounds and use thereof UNG, MRM1, OGG1 FFAR1 3020/4885PPARD 2981/4885MCL1 76/4885

“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.