SCHEMBL7149139

SCHEMBL7149139

COc1cc(C(C)(C)C)c2op(Cl)oc3c(C(C)(C)C)cc(OC)cc3c2c1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
HPGD P15428 2/20 0.33
LMNA P02545 1/20 0.33
TP53 P04637 1/20 0.33
CYP3A4 P08684 1/20 0.33
ALOX15 P16050 1/20 0.33
ALDH1A1 P00352 2/20 0.32
POLB P06746 1/20 0.32
GAA P10253 1/20 0.31

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
SCHEMBL17126987 0.93 CA2 (0.40) CA1CA2ALDH1A1POLB
SCHEMBL24272781 0.85 CA1 (0.47) CA1CA2HPGDLMNATP53
SCHEMBL6906715 0.83 CA1 (0.46) CA1CA2HPGDLMNATP53
SCHEMBL29851517 0.83 CA1 (0.46) CA1CA2HPGDLMNATP53
SCHEMBL9192345 0.83 CA1 (0.50) CA1CA2HPGDLMNATP53
SCHEMBL20696115 0.83 CA1 (0.46) CA1CA2HPGDLMNATP53
SCHEMBL31072319 0.82 CA1 (0.44) CA1CA2HPGDLMNATP53
SCHEMBL17399584 0.81 CA1 (0.43) CA1CA2HPGDLMNATP53
SCHEMBL14570690 0.79 ELANE (0.38) CA2
SCHEMBL18951286 0.77 CA2 (0.33) CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3031817-B1 TERPHENYL-2-OXY-PHOSPHITE AS LIGANDS IN HYDROFORMYLATION CATALYSTS EVONIK DEGUSSA GMBH (DE) 2019-05-01 EP disclosed
EP-3459960-A1 BISPHOSPHITE LIGANDS WITH DIOXAPHOSPHEPIN BUILDING BLOCKS Evonik Degussa GmbH (DE) 2019-03-27 EP disclosed
EP-3459961-A1 FOUR-TOOTHED PHOSPHINO PHOSPHITES Evonik Degussa GmbH (DE) 2019-03-27 EP disclosed
EP-3031815-B1 TERPHENYL-2-OXY-PHOSPHITES AS LIGANDS IN HYDROFORMYLATION CATALYSTS EVONIK DEGUSSA GMBH (DE) 2019-02-20 EP disclosed
US-10011619-B2 Process for reducing the chlorine content of organotetraphosphites EVONIK DEGUSSA GMBH (DE) 2018-07-03 US disclosed
EP-3029052-B1 9-Anthrol-monophosphit Esters as Ligands for Hydroformylation Catalysts EVONIK DEGUSSA GMBH (DE) 2018-02-28 EP disclosed
EP-3101022-B1 MONOPHOSPHITES HAVING AN UNSYMMETRIC BIARYL UNIT EVONIK DEGUSSA GMBH (DE) 2018-02-28 EP disclosed
EP-3070093-B1 NOVEL ORGANOPHOSPHORUS COMPOUNDS BASED ON ANTHRACENTRIOL EVONIK DEGUSSA GMBH (DE) 2018-02-07 EP disclosed
EP-3112373-B1 NOVEL TETRADENTATE PHOSPHORUS LIGAND WITH HOSTANOX O3 GUIDE STRUCTURE EVONIK DEGUSSA GMBH (DE) 2017-08-30 EP disclosed
US-9701697-B2 Process for reducing the chlorine content of organotetraphosphites EVONIK DEGUSSA GMBH (DE) 2017-07-11 US disclosed
US-8003816-B2 Bisphosphite ligands for hydroformylation catalyzed by transition metals EVONIK OXENO GMBH (DE) 2011-08-23 US disclosed
US-8003816-B2 Bisphosphite ligands for hydroformylation catalyzed by transition metals EVONIK OXENO GMBH (DE) 2011-08-23 US disclosed
EP-2091958-B1 BISPHOSPHITE LIGANDS FOR HYDROFORMYLATION CATALYZED BY TRANSITION METALS EVONIK OXENO GMBH (DE) 2011-04-27 EP disclosed
US-20100036143-A1 BISPHOSPHITE LIGANDS FOR HYDROFORMYLATION CATALYZED BY TRANSITION METALS EVONIK OXENO GMBH (DE) 2010-02-11 US disclosed
US-20100036143-A1 BISPHOSPHITE LIGANDS FOR HYDROFORMYLATION CATALYZED BY TRANSITION METALS EVONIK OXENO GMBH (DE) 2010-02-11 US disclosed
WO-2008071508-A1 BISPHOSPHITE LIGANDS FOR HYDROFORMYLATION CATALYZED BY TRANSITION METALS EVONIK OXENO GMBH (DE) 2008-06-19 WO disclosed
US-6525143-B2 Separation of catalyst by membrane filtration UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION 2003-02-25 US disclosed
US-20020111438-A1 Dendritic macromolecules for metal-ligand catalyzed processes UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY LLC 2002-08-15 US disclosed
WO-2002034389-A2 DENDRITIC MACROMOLECULES FOR METAL-LIGAND CATALYZED PROCESSES UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 2002-05-02 WO disclosed
US-6350819-B1 SEPARATION OF THE DESIRED PRODUCT FROM THE CATALYST IS FACILITATED; HYDROFORMYLATION CATALYST; BRANCHES CONTAIN TERMINAL GROUPS DERIVED FROM ORGANOPHOSPHITES, ORGANOPHOSPHONITES AND/OR ORGANOPHOSPHINITES. UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION 2002-02-26 US 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-20100036143-A1 BISPHOSPHITE LIGANDS FOR HYDROFORMYLATION CATALYZED BY TRANSITION METALS SLC9B2, CTR9, POF1B CA1 2038/4885CA2 429/4885HPGD 1390/4885
US-10011619-B2 Process for reducing the chlorine content of organotetraphosphites DCPS, DDT, TET2 CA1 665/4885CA2 356/4885HPGD 3555/4885

“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.