SCHEMBL1886840

SCHEMBL1886840

Fc1cc(F)c(-c2c(Cl)nc3ncccc3c2Cl)c(F)c1

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.36
F2 P00734 1/20 0.35
F10 P00742 1/20 0.35
F7 P08709 1/20 0.35
F3 P13726 1/20 0.35
IDO1 P14902 2/20 0.35
ABCG2 Q9UNQ0 3/20 0.34
CCR1 P32246 1/20 0.34
CCR8 P51685 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
TRPA1 O75762 1/20 0.33
NR4A2 P43354 1/20 0.33
HCAR2 Q8TDS4 2/20 0.33
ACHE P22303 1/20 0.33
PRKCQ Q04759 1/20 0.32
PRKCD Q05655 1/20 0.32
COMT P21964 1/20 0.32

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
SCHEMBL4162350 0.79
SCHEMBL1882670 0.79 MAPK14 (0.39) IDO1ABCG2ACHE
SCHEMBL1887676 0.79 MAPK14 (0.39) IDO1ABCG2L3MBTL1NR4A2ACHE
SCHEMBL4151460 0.77 PRKD3 (0.33)
SCHEMBL1883929 0.77 PIK3CA (0.42)
SCHEMBL4718820 0.77
SCHEMBL1883294 0.77 TOP1 (0.39) ALDH1A1CCR1CCR8L3MBTL1NR4A2
SCHEMBL1892023 0.71 F7 (0.38) F10F7F3IDO1ACHE
SCHEMBL252439 0.69 L3MBTL1 (0.44) ALDH1A1IDO1CCR1CCR8L3MBTL1
SCHEMBL4022147 0.69 METAP1 (0.51) ALDH1A1CCR1CCR8L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7947679-B2 Fungicides SYNGENTA CROP PROTECTION, INC. (US) 2011-05-24 US disclosed
US-7947679-B2 Fungicides SYNGENTA CROP PROTECTION, INC. (US) 2011-05-24 US disclosed
US-7947679-B2 Fungicides SYNGENTA CROP PROTECTION, INC. (US) 2011-05-24 US disclosed
EP-1585746-B1 NAPHTHYRIDINE DERIVATIVES AND THEIR USE AS FUNGICIDES SYNGENTA LTD (GB) 2007-01-31 EP disclosed
US-20060069089-A1 Fungicides SYNGENTA CROP PROTECTION, INC. 2006-03-30 US disclosed
EP-1585746-A2 NAPHTHYRIDINE DERIVATIVES AND THEIR USE AS FUNGICIDES Syngenta Limited (GB) 2005-10-19 EP disclosed
WO-2004056824-A2 NAPHTHYRIDINE DERIVATIVES AND THEIR USE AS FUNGICIDES SYNGENTA LIMITED (GB) 2004-07-08 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-20060069089-A1 Fungicides CBR3, TACR3, HCRTR1 ALDH1A1 3663/4885F2 4425/4885F10 3649/4885

“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.