SCHEMBL920044

SCHEMBL920044

CC=C(C)COc1cc[c]cc1

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
WDR5 P61964 1/20 0.32
ALOX15 P16050 1/20 0.32
MAOB P27338 4/20 0.32
AOC3 Q16853 3/20 0.32
SMN1; SMN2 Q16637 1/20 0.31
AOC2 O75106 2/20 0.30
MAOA P21397 2/20 0.30
DAO P14920 1/20 0.30
NQO1 P15559 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
SCHEMBL920042 1.00 WDR5 (0.32) WDR5ALOX15MAOBAOC3SMN1; SMN2
SCHEMBL921139 0.78 ALOX15 (0.32) ALOX15MAOBAOC3AOC2MAOA
SCHEMBL921140 0.78 ALOX15 (0.32) ALOX15MAOBAOC3AOC2MAOA
SCHEMBL5146395 0.78 GPR174 (0.46) WDR5ALOX15SMN1; SMN2
SCHEMBL3843221 0.78 FFAR1 (0.41) WDR5ALOX15SMN1; SMN2NQO1
SCHEMBL3169853 0.78 ALOX15 (0.42) ALOX15MAOBSMN1; SMN2
SCHEMBL919166 0.75 MAOB (0.32) MAOBAOC3SMN1; SMN2
SCHEMBL919167 0.75 MAOB (0.32) MAOBAOC3SMN1; SMN2
SCHEMBL14548246 0.73 MMP2 (0.51)
SCHEMBL17615977 0.73 MMP2 (0.51)

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 WDR5 76/4885ALOX15 1580/4885MAOB 3730/4885
US-20110201649-A1 AGRICULTURAL COMPOSITION H1-0, H1-3, H1-2 WDR5 52/4885ALOX15 3969/4885MAOB 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.