SCHEMBL878309

SCHEMBL878309

CCCCOP(=O)(Oc1ccccc1)c1ccccc1

nearest known ligand 0.69

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.59
L3MBTL1 Q9Y468 1/20 0.59
CA12 O43570 5/20 0.57
CA1 P00915 5/20 0.57
CA2 P00918 5/20 0.57
CA4 P22748 5/20 0.57
CA5A P35218 5/20 0.57
CA7 P43166 5/20 0.57
CA9 Q16790 5/20 0.57
CA5B Q9Y2D0 5/20 0.57
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
LTA4H P09960 1/20 0.46

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
SCHEMBL27540640 0.94 TDP1 (0.56) TDP1L3MBTL1CA12CA1CA2
SCHEMBL27511509 0.94 TDP1 (0.56) TDP1L3MBTL1CA12CA1CA2
SCHEMBL11317521 0.94 TDP1 (0.56) TDP1L3MBTL1CA12CA1CA2
SCHEMBL11312973 0.94 TDP1 (0.56) TDP1L3MBTL1CA12CA1CA2
SCHEMBL20710851 0.90 L3MBTL1 (0.63) TDP1L3MBTL1CA12CA1CA2
SCHEMBL777797 0.88 MEN1 (0.56) CA12CA1CA2CA4CA5A
SCHEMBL28254358 0.85 MEN1 (0.62) CA12CA1CA2CA4CA5A
SCHEMBL18334409 0.83 MEN1 (0.51) CA12CA1CA2CA4CA5A
SCHEMBL11818661 0.83 MEN1 (0.51) MEN1KMT2ALTA4H
SCHEMBL18261836 0.83 MEN1 (0.51) CA12CA1CA2CA4CA5A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113736075-B Preparation method of polylactone 深圳大学 2022-06-24 CN disclosed
CN-113736075-A Preparation method of polylactone 深圳大学 2021-12-03 CN disclosed
CN-112645978-A Use of heteropolyacids in the catalytic synthesis of a material compound 山东卓俊实业有限公司 2021-04-13 CN disclosed
CN-112625063-A Preparation method of material compound 商河知济新材料技术中心 2021-04-09 CN disclosed
US-10927135-B2 Metal-free direct arylation of dialkyl phosphonates for the synthesis of mixed alkyl aryl phosphonates THE BOARD OF REGENTS OF THE NEVADA SYSTEM OF HIGHER EDUCATION ON BEHALF OF THE UNIVERSITY OF NEVADA, LAS VEGAS (US) 2021-02-23 US disclosed
US-10927135-B2 Metal-free direct arylation of dialkyl phosphonates for the synthesis of mixed alkyl aryl phosphonates THE BOARD OF REGENTS OF THE NEVADA SYSTEM OF HIGHER EDUCATION ON BEHALF OF THE UNIVERSITY OF NEVADA, LAS VEGAS (US) 2021-02-23 US disclosed
US-20200255461-A1 METAL-FREE DIRECT ARYLATION OF DIALKYL PHOSPHONATES FOR THE SYNTHESIS OF MIXED ALKYL ARYL PHOSPHONATES THE BOARD OF REGENTS OF THE NEVADA SYSTEM OF HIGHER EDUCATION ON BEHALF OF THE UNIVERSITY OF NEVADA, LAS VEGAS 2020-08-13 US disclosed
US-20200255461-A1 METAL-FREE DIRECT ARYLATION OF DIALKYL PHOSPHONATES FOR THE SYNTHESIS OF MIXED ALKYL ARYL PHOSPHONATES THE BOARD OF REGENTS OF THE NEVADA SYSTEM OF HIGHER EDUCATION ON BEHALF OF THE UNIVERSITY OF NEVADA, LAS VEGAS 2020-08-13 US disclosed
WO-2019028391-A1 METAL-FREE DIRECT ARYLATION OF DIALKYL PHOSPHONATES FOR THE SYNTHESIS OF MIXED ALKYL ARYL PHOSPHONATES THE BOARD OF REGENTS OF THE NEVADA SYSTEM OF HIGHER EDUCATION ON BEHALF OF THE UNIVERSITY OF NEVADA, LAS VEGAS (US) 2019-02-07 WO disclosed
CN-108291157-A Selective hydrogenation using flow index 切弗朗菲利浦化学公司 2018-07-17 CN disclosed
CN-107107049-A Selective hydrogenation catalyst and its preparation and application 切弗朗菲利浦化学公司 2017-08-29 CN disclosed
CN-102341175-B Selective hydrogenation catalyst and preparation and application thereof Chevron Phillips Chemical Co.,L.P. (US) 2016-11-30 CN disclosed
EP-2619213-A1 MONOHYDROXY CYCLIC PHOSPHONATE SUBSTANTIALLY FREE OF POLYHYDOXY PHOSPHONATE, PROCESS FOR MAKING SAME AND FLAME RETARDANT FLEXIBLE POLYURETHANE FOAM OBTAINED THEREFROM ICL-IP America Inc. (US) 2013-07-31 EP disclosed
WO-2012040074-A1 MONOHYDROXY CYCLIC PHOSPHONATE SUBSTANTIALLY FREE OF POLYHYDOXY PHOSPHONATE, PROCESS FOR MAKING SAME AND FLAME RETARDANT FLEXIBLE POLYURETHANE FOAM OBTAINED THEREFROM ICL-IP AMERICA INC. (US) 2012-03-29 WO disclosed
CN-102341175-A Selective hydrogenation catalyst and methods of making and using same CHEVRON PHILLIPS CHEMICAL CO 2012-02-01 CN 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-20200255461-A1 METAL-FREE DIRECT ARYLATION OF DIALKYL PHOSPHONATES FOR THE SYNTHESIS OF MIXED ALKYL ARYL PHOSPHONATES SLC35B2, PPIP5K2, PPA1 TDP1 2650/4885L3MBTL1 4127/4885CA12 3108/4885
US-10927135-B2 Metal-free direct arylation of dialkyl phosphonates for the synthesis of mixed alkyl aryl phosphonates SLC35B2, PPIP5K2, PPA1 TDP1 2650/4885L3MBTL1 4127/4885CA12 3108/4885

“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.