SCHEMBL1306136

SCHEMBL1306136

CCOP(=O)(OCC)c1ccc(OC)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP9 P14780 3/20 0.46
ADAM17 P78536 2/20 0.46
MMP3 P08254 2/20 0.46
MMP1 P03956 1/20 0.46
CA1 P00915 3/20 0.45
CA2 P00918 3/20 0.45
CA12 O43570 2/20 0.45
CA7 P43166 2/20 0.45
CA9 Q16790 2/20 0.45
CA4 P22748 1/20 0.45
CA5A P35218 1/20 0.45
CA5B Q9Y2D0 1/20 0.45
CA14 Q9ULX7 1/20 0.44
KMT2A Q03164 3/20 0.42
MAPT P10636 2/20 0.42
TDP1 Q9NUW8 1/20 0.42
GAA P10253 2/20 0.41
MEN1 O00255 2/20 0.41
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 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
SCHEMBL6829825 0.87 TDP1 (0.49) CA1CA2CA12CA7CA9
SCHEMBL14809991 0.87 CA12 (0.43) MMP9ADAM17MMP3MMP1CA1
SCHEMBL11609892 0.82 MMP9 (0.45) MMP9ADAM17MMP3MMP1CA1
SCHEMBL9407115 0.81 TDP1 (0.45) CA1CA2CA12CA7CA9
SCHEMBL16868490 0.81 MMP9 (0.47) MMP9ADAM17MMP3MMP1CA1
SCHEMBL11343746 0.81 MMP9 (0.44) MMP9ADAM17MMP3MMP1CA1
SCHEMBL459400 0.80 ALDH1A1 (0.44) CA1CA2CA12CA7CA9
SCHEMBL107781 0.79 HPGD (0.48) CA1CA2CA12CA7CA9
SCHEMBL10721682 0.79 CA1 (0.52) CA1CA2CA12CA7CA9
SCHEMBL1001220 0.78 CA1 (0.58) CA1CA2CA12CA7CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8062816-B2 Phosphonate hole blocking layer photoconductors XEROX CORPORATION (US) 2011-11-22 US claimed
US-8053151-B2 Phosphonate containing photoconductors XEROX CORPORATION (US) 2011-11-08 US claimed
EP-2141545-A1 Phosphonate containing photoconductors Xerox Corporation (US) 2010-01-06 EP claimed
US-20090325091-A1 PHOSPHONATE CONTAINING PHOTOCONDUCTORS XEROX CORPORATION (US) 2009-12-31 US claimed
US-20090297967-A1 PHOSPHONATE HOLE BLOCKING LAYER PHOTOCONDUCTORS XEROX CORPORATION (US) 2009-12-03 US claimed
EP-2128709-A1 Phosphonate Hole Blocking Layer Photoconductors Xerox Corporation (US) 2009-12-02 EP claimed
CN-116425794-A Aryl phosphonate compound and preparation method thereof 烟台大学 2023-07-14 CN disclosed
CN-111032737-B Ethylene imine polymer solution and method for producing same 株式会社日本触媒 2022-06-14 CN disclosed
CN-111032737-A Ethylene imine polymer solution and method for producing same 株式会社日本触媒 2020-04-17 CN disclosed
WO-2015031725-A1 TRANSITION METAL-CATALYZED IMIDATION OF ARENES PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2015-03-05 WO disclosed
EP-1827688-B1 NOVEL METATHESIS RUTHENIUM CATALYST BOEHRINGER INGELHEIM INT (DE) 2014-09-03 EP disclosed
US-8062816-B2 Phosphonate hole blocking layer photoconductors XEROX CORPORATION (US) 2011-11-22 US disclosed
US-8053151-B2 Phosphonate containing photoconductors XEROX CORPORATION (US) 2011-11-08 US disclosed
US-20090297967-A1 PHOSPHONATE HOLE BLOCKING LAYER PHOTOCONDUCTORS XEROX CORPORATION (US) 2009-12-03 US disclosed
EP-2128709-A1 Phosphonate Hole Blocking Layer Photoconductors Xerox Corporation (US) 2009-12-02 EP disclosed
EP-1827688-A1 NOVEL METATHESIS RUTHENIUM CATALYST BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2007-09-05 EP disclosed
US-7109344-B2 Prepared from 2-alkoxy-5-styrene derivatives, used for ring-closing metathesis, cross metathesis or ene-ine metathesis reactions BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2006-09-19 US disclosed
US-20050143580-A1 Novel ruthenium catalyst BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2005-06-30 US disclosed
EP-1543875-A1 Novel metathesis ruthenium catalyst Boehringer Ingelheim Pharma GmbH & Co. KG (DE) 2005-06-22 EP disclosed
WO-2005053843-A1 NOVEL METATHESIS RUTHENIUM CATALYST BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2005-06-16 WO 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-20050143580-A1 Novel ruthenium catalyst CCNE1, CCNE2, RER1 MMP9 3158/4885ADAM17 4037/4885MMP3 2567/4885

“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.