SCHEMBL920508

SCHEMBL920508

N#Cc1cccc(COc2cc[c]c(F)c2)c1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 2/20 0.50
FFAR4 Q5NUL3 1/20 0.50
MAOB P27338 5/20 0.48
MAOA P21397 2/20 0.48
MRGPRX4 Q96LA9 2/20 0.47
GRM5 P41594 2/20 0.46
CYP4F2 P78329 1/20 0.45
CYP4A11 Q02928 1/20 0.45
PDCD1 Q15116 1/20 0.43
CD274 Q9NZQ7 1/20 0.43
CYP19A1 P11511 1/20 0.42
CYP11B1 P15538 1/20 0.42
CYP11B2 P19099 1/20 0.42
ALKBH1 Q13686 1/20 0.42
KCNH2 Q12809 1/20 0.42
ALOX5 P09917 1/20 0.41
ALOX5AP P20292 1/20 0.41
SPHK1 Q9NYA1 1/20 0.41

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
SCHEMBL919526 0.85 MAOB (0.51) MAOBMAOACYP4F2CYP4A11
SCHEMBL863622 0.84 FFAR1 (0.58) FFAR1FFAR4MAOBMAOAMRGPRX4
SCHEMBL921277 0.81 MAOB (0.59) MAOBMAOA
SCHEMBL920621 0.79 ALOX5 (0.51) MAOBMAOACYP4F2CYP4A11ALOX5
SCHEMBL921872 0.79 MAOB (0.54) MAOBMAOAALOX5
SCHEMBL920443 0.79 MAOB (0.57) MAOBMAOAGRM5
SCHEMBL920009 0.79 PDE4A (0.42) FFAR1FFAR4
SCHEMBL920733 0.78 MAOB (0.62) MAOBMRGPRX4
SCHEMBL1248693 0.78 MAOB (0.66) FFAR1FFAR4MAOBMAOAMRGPRX4
SCHEMBL919374 0.76 FFAR1 (0.53) FFAR1FFAR4MAOBMAOAMRGPRX4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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

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-20110009454-A1 COMPOSITION FOR AGRICULTURAL USE FOR CONTROLLING OR PREVENTING PLANT DISEASES CAUSED BY PLANT PATHOGENS WIZ, TST, NAT1 FFAR1 3411/4885FFAR4 4404/4885MAOB 3730/4885
US-20110201649-A1 AGRICULTURAL COMPOSITION H1-0, H1-3, H1-2 FFAR1 2357/4885FFAR4 4184/4885MAOB 4351/4885

“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.