SCHEMBL921256

SCHEMBL921256

CCc1ccc(Oc2cccc(C#N)c2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 1/20 0.52
PDE4A P27815 1/20 0.46
PDE4B Q07343 1/20 0.46
PDE4C Q08493 1/20 0.46
PDE4D Q08499 1/20 0.46
PGR P06401 1/20 0.44
GRIN1 Q05586 1/20 0.43
GRIN2B Q13224 1/20 0.43
FNTA P49354 1/20 0.43
FNTB P49356 1/20 0.43
PGGT1B P53609 1/20 0.43
AR P10275 1/20 0.41
CACNA1G O43497 1/20 0.41
CACNA1B Q00975 1/20 0.41
FFAR1 O14842 1/20 0.41
FFAR4 Q5NUL3 1/20 0.41
SCN9A Q15858 1/20 0.41
LTA4H P09960 1/20 0.41
CYP19A1 P11511 1/20 0.41
GPR119 Q8TDV5 1/20 0.40

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
SCHEMBL920830 0.89 CYP2A6 (0.44) CYP2A6PDE4APDE4BPDE4CPDE4D
SCHEMBL921857 0.88 FFAR1 (0.45) PDE4APDE4BPDE4CPDE4DPGR
SCHEMBL10923033 0.86 PDE4A (0.55) PDE4APDE4BPDE4CPDE4DPGR
SCHEMBL506364 0.85 ST14 (0.56) PDE4APDE4BPDE4CPDE4DPGR
SCHEMBL923347 0.85 LTA4H (0.59) PDE4APDE4BPDE4CPDE4DPGR
SCHEMBL3167195 0.84 PDE4A (0.46) PDE4APDE4BPDE4CPDE4DPGR
SCHEMBL3164499 0.84 LTA4H (0.58) PDE4APDE4BPDE4CPDE4DPGR
SCHEMBL17052990 0.84 CYP2A6 (0.52) CYP2A6PGRARCACNA1GCACNA1B
SCHEMBL15604704 0.83 CYP2A6 (0.76) CYP2A6PGRCACNA1GCACNA1BCYP19A1
SCHEMBL921023 0.83 LTA4H (0.62) PDE4APDE4BPDE4CPDE4DLTA4H

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 CYP2A6 3797/4885PDE4A 4539/4885PDE4B 4455/4885

“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.