SCHEMBL921857

SCHEMBL921857

CCCc1ccc(Oc2cccc(C#N)c2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 4/20 0.45
FFAR4 Q5NUL3 2/20 0.45
PDE4A P27815 1/20 0.44
PDE4B Q07343 1/20 0.44
PDE4C Q08493 1/20 0.44
PDE4D Q08499 1/20 0.44
FDFT1 P37268 1/20 0.43
PGR P06401 1/20 0.42
GRIN1 Q05586 1/20 0.41
GRIN2B Q13224 1/20 0.41
FNTA P49354 1/20 0.41
FNTB P49356 1/20 0.41
PGGT1B P53609 1/20 0.41
CTSS P25774 1/20 0.41
CTSK P43235 1/20 0.41
CYP11B1 P15538 1/20 0.40
CYP11B2 P19099 1/20 0.40
LTA4H P09960 1/20 0.40
AR P10275 1/20 0.40
SCN9A Q15858 1/20 0.39

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
SCHEMBL921256 0.88 CYP2A6 (0.52) FFAR1FFAR4PDE4APDE4BPDE4C
SCHEMBL921444 0.84 CYP2A6 (0.53) PGR
SCHEMBL10923033 0.83 PDE4A (0.55) PDE4APDE4BPDE4CPDE4DPGR
SCHEMBL921023 0.83 LTA4H (0.62) PDE4APDE4BPDE4CPDE4DCYP11B1
SCHEMBL923347 0.83 LTA4H (0.59) PDE4APDE4BPDE4CPDE4DPGR
SCHEMBL506364 0.83 ST14 (0.56) FFAR1FFAR4PDE4APDE4BPDE4C
SCHEMBL3164499 0.81 LTA4H (0.58) FFAR1FFAR4PDE4APDE4BPDE4C
SCHEMBL3167195 0.81 PDE4A (0.46) FFAR1FFAR4PDE4APDE4BPDE4C
SCHEMBL25381878 0.80 FDFT1 (0.57) FFAR1FFAR4FDFT1
SCHEMBL8379001 0.80 PDE4A (0.54) FFAR1FFAR4PDE4APDE4BPDE4C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
WO-2009107764-A1 COMPOSITION FOR AGRICULTURAL USE FOR CONTROLLING OR PREVENTING PLANT DISEASES CAUSED BY PLANT PATHOGENS 住友化学株式会社 (JP) 2009-09-03 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-20110009454-A1 COMPOSITION FOR AGRICULTURAL USE FOR CONTROLLING OR PREVENTING PLANT DISEASES CAUSED BY PLANT PATHOGENS WIZ, TST, NAT1 FFAR1 3411/4885FFAR4 4404/4885PDE4A 4539/4885

“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.