SCHEMBL677571

SCHEMBL677571

COc1cc(C)c(C(=O)O)c(OC)c1OC

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.54
MAPT P10636 4/20 0.54
KMT2A Q03164 4/20 0.54
CYP3A4 P08684 3/20 0.54
POLB P06746 3/20 0.54
MEN1 O00255 2/20 0.54
TDP1 Q9NUW8 2/20 0.54
GFER P55789 1/20 0.54
NPSR1 Q6W5P4 1/20 0.54
TPMT P51580 1/20 0.49
ALDH1A1 P00352 7/20 0.47
KDM4E B2RXH2 6/20 0.47
HSD17B10 Q99714 3/20 0.47
HTR1A P08908 1/20 0.47
HTR2C P28335 1/20 0.47
CA12 O43570 1/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
CA7 P43166 1/20 0.47
CA9 Q16790 1/20 0.47

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
SCHEMBL27491445 0.89 CYP3A4 (0.54) HPGDMAPTKMT2ACYP3A4POLB
SCHEMBL14094952 0.87 CYP3A4 (0.68) HPGDMAPTKMT2ACYP3A4POLB
SCHEMBL27813524 0.86 ACHE (0.45) HPGDMAPTKMT2ACYP3A4POLB
SCHEMBL31638876 0.86 CYP3A4 (0.63) HPGDMAPTKMT2ACYP3A4POLB
SCHEMBL19420644 0.84 MAPT (0.50) HPGDMAPTKMT2ACYP3A4POLB
SCHEMBL12587644 0.83 POLB (0.57) HPGDMAPTKMT2ACYP3A4POLB
SCHEMBL5588217 0.83 CYP3A4 (0.56) HPGDMAPTKMT2ACYP3A4POLB
SCHEMBL677238 0.83 MAPT (0.42) HPGDMAPTKMT2ACYP3A4POLB
SCHEMBL7943881 0.81 ATM (0.54) HPGDMAPTKMT2ACYP3A4POLB
SCHEMBL4397386 0.81 TPMT (0.58) HPGDMAPTKMT2ACYP3A4POLB

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 30 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170188579-A1 FUNGICIDAL COMPOSITION AND METHOD FOR CONTROLLING PLANT DISEASES ISHIHARA SANGYO KAISHA (JP) 2017-07-06 US disclosed
US-9655362-B2 Fungicidal composition and method for controlling plant diseases ISHIHARA SANGYO KAISHA, LTD. (JP) 2017-05-23 US disclosed
EP-2308861-B1 MACROCYCLIC COMPOUNDS USEFUL AS PHARMACEUTICALS EISAI R&D MAN CO LTD (JP) 2017-03-01 EP disclosed
CN-103478142-B The method of control of microbicide compositions and plant disease ISHIHARA SANGYO KAISHA, LTD. (JP) 2016-03-30 CN disclosed
EP-1679003-B1 BACTERICIDE COMPOSITION AND METHOD OF CONTROLLING PLANT DISEASE ISHIHARA SANGYO KAISHA (JP) 2015-04-15 EP disclosed
US-8653277-B2 Fungicidal composition and method for controlling plant diseases ISHIHARA SANGYO KAISHA, LTD. (JP) 2014-02-18 US disclosed
US-8653113-B2 Fungicidal composition and method for controlling plant diseases ISHIHARA SANGYO KAISHA, LTD. (JP) 2014-02-18 US disclosed
CN-103478142-A Bactericide composition and method of controlling plant disease ISHIHARA SANGYO KAISHA 2014-01-01 CN disclosed
US-8609150-B2 Fungicidal composition and method for controlling plant diseases ISHIHARA SANGYO KAISHA, LTD. (JP) 2013-12-17 US disclosed
CN-102165961-B Bactericide composition and method of controlling plant disease ISHIHARA SANGYO KAISHA 2013-10-23 CN disclosed
US-7915306-B2 For therapy of inflammatory or autoimmune disorders EISAI CO., LTD. (JP) 2011-03-29 US disclosed
US-7799827-B2 Macrocyclic compounds useful as pharmaceuticals EISAI CO., LTD. (JP) 2010-09-21 US disclosed
US-7799827-B2 Macrocyclic compounds useful as pharmaceuticals EISAI CO., LTD. (JP) 2010-09-21 US disclosed
CN-101822253-A The method of control of microbicide compositions and plant disease ISHIHARA SANGYO KAISHA 2010-09-08 CN disclosed
CN-100581362-C Bactericide composition and method for controlling plant diseases ISHIHARA SANGYO KAISHA 2010-01-20 CN disclosed
US-20090247763-A1 FUNGICIDAL COMPOSITION AND METHOD FOR CONTROLLING PLANT DISEASES ISHIHARA SANGYO KAISHA, LTD. (JP) 2009-10-01 US disclosed
CN-101199274-A Bactericide composition and method for controlling plant disease ISHIHARA SANGYO KAISHA (JP) 2008-06-18 CN disclosed
CN-1874680-A bactericide composition and method for controlling plant diseases ISHIHARA SANGYO KAISHA (JP) 2006-12-06 CN disclosed
US-20060194849-A1 Fungicidal composition and method for controlling plant diseases ISHIHARA SANGYO KAISHA, LTD. (JP) 2006-08-31 US disclosed
EP-1679003-A1 BACTERICIDE COMPOSITION AND METHOD OF CONTROLLING PLANT DISEASE ISHIHARA SANGYO KAISHA, LTD. (JP) 2006-07-12 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-20090247763-A1 FUNGICIDAL COMPOSITION AND METHOD FOR CONTROLLING PLANT DISEASES CBR3, CBR1, CNPY2 HPGD 1354/4885MAPT 4140/4885KMT2A 2040/4885
US-20060194849-A1 Fungicidal composition and method for controlling plant diseases CBR3, CNPY2, PAH HPGD 1278/4885MAPT 4366/4885KMT2A 2575/4885
US-20170188579-A1 FUNGICIDAL COMPOSITION AND METHOD FOR CONTROLLING PLANT DISEASES CBR3, CNPY2, PAH HPGD 1278/4885MAPT 4366/4885KMT2A 2575/4885

“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.