SCHEMBL685639

SCHEMBL685639

O=P(CCO)(c1ccccc1)c1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 1.00
ALDH1A1 P00352 3/20 0.65
KMT2A Q03164 3/20 0.65
MEN1 O00255 2/20 0.65
MAPT P10636 2/20 0.64
NPSR1 Q6W5P4 2/20 0.64
ALPG P10696 1/20 0.64
ALOX12 P18054 1/20 0.64
NPY1R P25929 1/20 0.64
HTT P42858 1/20 0.64
NPY2R P49146 1/20 0.64
USP2 O75604 1/20 0.56
CFTR P13569 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.53
CA2 P00918 1/20 0.48
CA4 P22748 1/20 0.48
CA5A P35218 1/20 0.48
POLB P06746 2/20 0.47
TDP1 Q9NUW8 1/20 0.47
LMNA P02545 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
Hydrogen Peroxide SCHEMBL8527081 0.87 ALDH1A1 (0.82) GAAALDH1A1KMT2AMEN1MAPT
SCHEMBL11329654 0.86 GAA (0.76) GAAALDH1A1KMT2AMEN1MAPT
SCHEMBL2381086 0.85 ALDH1A1 (0.77) GAAALDH1A1KMT2AMEN1MAPT
SCHEMBL11340059 0.85 ALDH1A1 (0.76) GAAALDH1A1KMT2AMEN1MAPT
Hydrogen Peroxide SCHEMBL8610678 0.83 ALDH1A1 (0.82) GAAALDH1A1KMT2AMEN1MAPT
Water SCHEMBL22228992 0.82 ALDH1A1 (0.74) GAAALDH1A1KMT2AMEN1MAPT
SCHEMBL3007003 0.81 GAA (0.68) GAAALDH1A1KMT2AMEN1MAPT
SCHEMBL4162470 0.80 ALDH1A1 (0.95) GAAALDH1A1KMT2AMEN1MAPT
SCHEMBL3410872 0.80 GAA (0.67) GAAALDH1A1KMT2AMEN1MAPT
SCHEMBL1801537 0.80 ALDH1A1 (0.86) GAAALDH1A1KMT2AMEN1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9822308-B2 Star-and tree-shaped branched polymers having flame-retardant properties UNIVERSITA' DEGLI STUDI DI MILANO (IT) 2017-11-21 US claimed
CN-103270082-B There is star and the branching polymer of anti-flammability 米兰大学 2016-08-17 CN claimed
US-20130281654-A1 STAR-AND TREE-SHAPED BRANCHED POLYMERS HAVING FLAME-RETARDANT PROPERTIES UNIVERSITA' DEGLI STUDI DI MILANO (IT) 2013-10-24 US claimed
EP-2652007-A1 STAR- AND TREE-SHAPED BRANCHED POLYMERS HAVING FLAME-RETARDANT PROPERTIES Universita' degli Studi di Milano (IT) 2013-10-23 EP claimed
WO-2012080304-A1 STAR- AND TREE-SHAPED BRANCHED POLYMERS HAVING FLAME-RETARDANT PROPERTIES UNIVERSITA' DEGLI STUDI DI MILANO (IT) 2012-06-21 WO claimed
US-9822308-B2 Star-and tree-shaped branched polymers having flame-retardant properties UNIVERSITA' DEGLI STUDI DI MILANO (IT) 2017-11-21 US disclosed
CN-103270082-B There is star and the branching polymer of anti-flammability 米兰大学 2016-08-17 CN disclosed
US-9309167-B2 Process for oligomerization of olefins that uses a catalytic composition that comprises an organometallic complex that contains an alkoxy ligand that is functionalized by a heteroatom IFP Energies Nouvelles (FR) 2016-04-12 US disclosed
US-9309167-B2 Process for oligomerization of olefins that uses a catalytic composition that comprises an organometallic complex that contains an alkoxy ligand that is functionalized by a heteroatom IFP Energies Nouvelles (FR) 2016-04-12 US disclosed
US-8624042-B2 Process for dimerization of ethylene to but-1-ene using a composition comprising a titanium-based complex and an alkoxy ligand functionalized by a heteroatom IFP Energies Nouvelles (FR) 2014-01-07 US disclosed
US-8624042-B2 Process for dimerization of ethylene to but-1-ene using a composition comprising a titanium-based complex and an alkoxy ligand functionalized by a heteroatom IFP Energies Nouvelles (FR) 2014-01-07 US disclosed
US-20130281654-A1 STAR-AND TREE-SHAPED BRANCHED POLYMERS HAVING FLAME-RETARDANT PROPERTIES UNIVERSITA' DEGLI STUDI DI MILANO (IT) 2013-10-24 US disclosed
US-20110288308-A1 PROCESS FOR DIMERIZATION OF ETHYLENE TO BUT-1-ENE USING A COMPOSITION COMPRISING A TITANIUM-BASED COMPLEX AND AN ALKOXY LIGAND FUNCTIONALIZED BY A HETEROATOM IFP Energies nouvelle (FR) 2011-11-24 US disclosed
US-20110288308-A1 PROCESS FOR DIMERIZATION OF ETHYLENE TO BUT-1-ENE USING A COMPOSITION COMPRISING A TITANIUM-BASED COMPLEX AND AN ALKOXY LIGAND FUNCTIONALIZED BY A HETEROATOM IFP Energies nouvelle (FR) 2011-11-24 US disclosed
US-20110287927-A1 PROCESS FOR OLIGOMERIZATION OF OLEFINS THAT USES A CATALYTIC COMPOSITION THAT COMPRISES AN ORGANOMETALLIC COMPLEX THAT CONTAINS AN ALKOXY LIGAND THAT IS FUNCTIONALIZED BY A HETEROATOM IFP Energies Nouvelles (FR) 2011-11-24 US disclosed
US-20110287927-A1 PROCESS FOR OLIGOMERIZATION OF OLEFINS THAT USES A CATALYTIC COMPOSITION THAT COMPRISES AN ORGANOMETALLIC COMPLEX THAT CONTAINS AN ALKOXY LIGAND THAT IS FUNCTIONALIZED BY A HETEROATOM IFP Energies Nouvelles (FR) 2011-11-24 US disclosed
EP-2388069-A1 Method for dimerisation of ethylene into butene-1 using a composition including a titanium complex and an alcoxy ligand functionalised by a heteroatom IFP Energies nouvelles (FR) 2011-11-23 EP disclosed
EP-0111950-B1 PROCESS FOR THE PREPARATION OF BISPHOSPHINE DIOXIDES SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1987-01-21 EP disclosed
US-4565892-A Process for the preparation of bisphosphine dioxides SHELL OIL COMPANY (US) 1986-01-21 US disclosed
EP-0111950-A2 Process for the preparation of bisphosphine dioxides SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1984-06-27 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-20110288308-A1 PROCESS FOR DIMERIZATION OF ETHYLENE TO BUT-1-ENE USING A COMPOSITION COMPRISING A TITANIUM-BASED COMPLEX AND AN ALKOXY LIGAND FUNCTIONALIZED BY A HETEROATOM AS3MT, ALK, AP2M1 GAA 2154/4885ALDH1A1 1420/4885KMT2A 3217/4885
US-20110287927-A1 PROCESS FOR OLIGOMERIZATION OF OLEFINS THAT USES A CATALYTIC COMPOSITION THAT COMPRISES AN ORGANOMETALLIC COMPLEX THAT CONTAINS AN ALKOXY LIGAND THAT IS FUNCTIONALIZED BY A HETEROATOM CPNE4, HAO2, AP2M1 GAA 3560/4885ALDH1A1 2242/4885KMT2A 3028/4885

“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.