SCHEMBL920377

SCHEMBL920377

Fc1cc(F)cc(Oc2c[c]ccc2)c1

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
VEGFA P15692 2/20 0.33
FFAR4 Q5NUL3 3/20 0.33
FFAR1 O14842 1/20 0.33
FDFT1 P37268 1/20 0.32
SLC6A2 P23975 2/20 0.31
SLC6A4 P31645 2/20 0.31
SLC6A3 Q01959 2/20 0.31
LTA4H P09960 1/20 0.31
TSHR P16473 1/20 0.31
EPAS1 Q99814 2/20 0.31
CYP1A2 P05177 1/20 0.30
CYP2A6 P11509 1/20 0.30
PTGS1 P23219 1/20 0.30
PTGS2 P35354 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
SCHEMBL921761 0.87 KDM4E (0.39) FFAR4FFAR1SLC6A2SLC6A4SLC6A3
SCHEMBL8155454 0.83 LTA4H (0.43) LTA4HTSHR
SCHEMBL4907828 0.83 RHEB (0.32) SLC6A2SLC6A4SLC6A3LTA4HTSHR
SCHEMBL157734 0.82 SOS1 (0.40) FFAR4FFAR1LTA4HTSHR
SCHEMBL2093164 0.81 POLB (0.33)
SCHEMBL27692978 0.81 SOS1 (0.39) FFAR4FFAR1LTA4HTSHR
SCHEMBL2750580 0.78 SOS1 (0.44) FDFT1SLC6A4PTGS1PTGS2
SCHEMBL61732 0.77 LTA4H (0.57) LTA4HTSHR
SCHEMBL2753690 0.77 LTA4H (0.31) LTA4HTSHR
SCHEMBL2753555 0.77 ALDH1A1 (0.42) LTA4HCYP1A2CYP2A6PTGS2

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-8178540-B2 Pyrimidylmethyl-sulfonamide compounds BASF SE (DE) 2012-05-15 US disclosed
US-20110201649-A1 AGRICULTURAL COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-08-18 US disclosed
EP-2345328-A1 COMPOSITION FOR AGRICULTURAL USE Sumitomo Chemical Company, Limited (JP) 2011-07-20 EP disclosed
US-20110009454-A1 COMPOSITION FOR AGRICULTURAL USE FOR CONTROLLING OR PREVENTING PLANT DISEASES CAUSED BY PLANT PATHOGENS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-01-13 US disclosed
EP-2248423-A1 COMPOSITION FOR AGRICULTURAL USE FOR CONTROLLING OR PREVENTING PLANT DISEASES CAUSED BY PLANT PATHOGENS Sumitomo Chemical Company, Limited (JP) 2010-11-10 EP disclosed
US-20100077512-A1 Pyridazin-4-ylmethyl-sulfonamides used as Fungicides and Against Arthropods BASF SE (DE) 2010-03-25 US disclosed
US-20100069243-A1 Pyrimidylmethyl-Sulfonamide Compounds BASF SE (DE) 2010-03-18 US 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 (4 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-20100069243-A1 Pyrimidylmethyl-Sulfonamide Compounds TPMT, NISCH, PPA1 VEGFA 3997/4885FFAR4 4612/4885FFAR1 4583/4885
US-20110009454-A1 COMPOSITION FOR AGRICULTURAL USE FOR CONTROLLING OR PREVENTING PLANT DISEASES CAUSED BY PLANT PATHOGENS WIZ, TST, NAT1 VEGFA 4619/4885FFAR4 4404/4885FFAR1 3411/4885
US-20100077512-A1 Pyridazin-4-ylmethyl-sulfonamides used as Fungicides and Against Arthropods PIR, PRDX4, PRDX2 VEGFA 4599/4885FFAR4 3666/4885FFAR1 4577/4885
US-20110201649-A1 AGRICULTURAL COMPOSITION H1-0, H1-3, H1-2 VEGFA 4106/4885FFAR4 4184/4885FFAR1 2357/4885

“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.