SCHEMBL919590

SCHEMBL919590

C#CCCOc1c[c]ccc1

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KCNA3 P22001 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
MAOB P27338 4/20 0.31
MAOA P21397 3/20 0.31
CA12 O43570 2/20 0.31
CA9 Q16790 2/20 0.31
TAAR1 Q96RJ0 1/20 0.31
ALDH1A1 P00352 1/20 0.31
RECQL P46063 1/20 0.31
GAA P10253 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
SCHEMBL919678 0.91 MAOB (0.39) KCNA3MAOBMAOACA12CA9
SCHEMBL920618 0.90 MAOB (0.40) KCNA3MAOBMAOACA12CA9
SCHEMBL921067 0.88 MAOB (0.40) KCNA3MAOBMAOACA12CA9
SCHEMBL5704638 0.82 KCNA3 (0.42) KCNA3MAOBMAOATAAR1ALDH1A1
SCHEMBL922668 0.81 GSTP1 (0.43) MAOBMAOACA12CA9
SCHEMBL4187224 0.79 KCNA3 (0.37) KCNA3TAAR1ALDH1A1RECQL
SCHEMBL920161 0.79 KCNA3 (0.31) KCNA3
SCHEMBL919633 0.79 GAA (0.38) KCNA3MEN1KMT2AMAOBMAOA
SCHEMBL3222353 0.79 KCNA3 (0.38) KCNA3GAA
SCHEMBL920060 0.78 CHRNB2 (0.34) KCNA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9730449-B2 Thiazole compound and its use in pest control SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-08-15 US disclosed
EP-3093286-A1 THIAZOLE COMPOUNDS AND PEST CONTROL APPLICATIONS THEREOF Sumitomo Chemical Co., Ltd (JP) 2016-11-16 EP disclosed
US-20160324155-A1 THIAZOLE COMPOUND AND ITS USE IN PEST CONTROL SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-11-10 US disclosed
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 (3 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-20160324155-A1 THIAZOLE COMPOUND AND ITS USE IN PEST CONTROL TRPA1, NAT1, TAS2R1 KCNA3 1136/4885MEN1 890/4885KMT2A 1487/4885
US-20110009454-A1 COMPOSITION FOR AGRICULTURAL USE FOR CONTROLLING OR PREVENTING PLANT DISEASES CAUSED BY PLANT PATHOGENS WIZ, TST, NAT1 KCNA3 2546/4885MEN1 4723/4885KMT2A 2469/4885
US-20110201649-A1 AGRICULTURAL COMPOSITION H1-0, H1-3, H1-2 KCNA3 1509/4885MEN1 1798/4885KMT2A 1924/4885

“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.