SCHEMBL921631

SCHEMBL921631

NCc1ccc(OC2=COC(Cc3ccccc3)O2)cc1

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAOB P27338 4/20 0.42
ST14 Q9Y5Y6 3/20 0.40
LOXL2 Q9Y4K0 2/20 0.39
TAAR1 Q96RJ0 1/20 0.35
MMP2 P08253 5/20 0.34
MMP9 P14780 5/20 0.34
MMP8 P22894 5/20 0.34
MMP14 P50281 5/20 0.34
LTA4H P09960 1/20 0.33

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
SCHEMBL922992 0.89 LOXL2 (0.37) MAOBLOXL2
SCHEMBL921952 0.82
SCHEMBL14919980 0.76 KDM1A (0.30) MAOB
SCHEMBL920810 0.76
SCHEMBL921079 0.76 MGLL (0.43) MAOB
SCHEMBL1656726 0.76 POLB (0.45)
SCHEMBL3524878 0.73 SLC6A2 (0.32)
SCHEMBL4981219 0.72 S1PR1 (0.44) MMP2MMP8
SCHEMBL74038 0.70
SCHEMBL121432 0.69 ST14 (0.71) MAOBST14LOXL2TAAR1LTA4H

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 2 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

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 MAOB 3730/4885ST14 708/4885LOXL2 2606/4885

“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.