SCHEMBL993799

SCHEMBL993799

Cc1cc(C(C)C)c(O)c(-c2c(C)c(C)cc(C(C)C)c2O)c1C

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 6/20 0.52
GABRB1 P18505 5/20 0.52
CA1 P00915 2/20 0.50
CA2 P00918 2/20 0.50
GABRB2 P47870 3/20 0.46
LMNA P02545 3/20 0.41
GSR P00390 1/20 0.39
SLC6A2 P23975 2/20 0.39
HTR2B P41595 2/20 0.39
FAAH O00519 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
HPGD P15428 1/20 0.39
TSHR P16473 1/20 0.39
GABRG2 P18507 1/20 0.39
PTGS1 P23219 1/20 0.39
HTR2C P28335 1/20 0.39
GABRB3 P28472 1/20 0.39
GABRA5 P31644 1/20 0.39
GABRA3 P34903 1/20 0.39

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
SCHEMBL4907907 0.84 CA1 (0.52) GABRA1GABRB1CA1CA2GABRB2
SCHEMBL214386 0.82 GABRA1 (0.46) GABRA1GABRB1CA1CA2GABRB2
SCHEMBL11989394 0.82 GABRA1 (0.40) GABRA1GABRB1CA1CA2GABRB2
SCHEMBL1973265 0.80 CA1 (0.48) GABRA1GABRB1CA1CA2GABRB2
SCHEMBL17281733 0.78 CA1 (0.56) GABRA1GABRB1CA1CA2GABRB2
SCHEMBL4625321 0.77 GABRA1 (0.46) GABRA1GABRB1CA1CA2GABRB2
SCHEMBL70105 0.77 CA1 (0.45) GABRA1GABRB1CA1CA2GABRB2
SCHEMBL17293890 0.76 ERN1 (0.42) GABRA1GABRB1CA1CA2LMNA
SCHEMBL29484753 0.76 CA1 (0.43) GABRA1GABRB1CA1CA2GABRB2
SCHEMBL11061545 0.75 CA1 (0.59) GABRA1GABRB1CA1CA2GABRB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2949638-B1 METHOD FOR THE PREPARATION OF 2,2 -BIPHENOLS USING SELENIUM DIOXIDE EVONIK DEGUSSA GMBH (DE) 2017-11-08 EP disclosed
EP-2421875-B1 HIGHLY SELECTIVE PROCESS FOR PRODUCING ORGANODIPHOSPHITES INVISTA TECHNOLOGIES SARL (CH) 2017-08-23 EP disclosed
US-9517986-B2 Process for preparing 2,2′-biphenols using selenium dioxide EVONIK DEGUSSA GMBH (DE) 2016-12-13 US disclosed
US-9517986-B2 Process for preparing 2,2′-biphenols using selenium dioxide EVONIK DEGUSSA GMBH (DE) 2016-12-13 US disclosed
EP-2421876-B1 HIGHLY SELECTIVE PROCESS FOR PRODUCING ORGANODIPHOSPHITES INVISTA Technologies S à r l (CH) 2016-07-27 EP disclosed
EP-2771347-B1 METHODS FOR PRODUCING ORGANODIPHOSPHITES FROM PHOSPHOROCHLORIDITES CHARACTERIZED BY MEASURING SIDE-PRODUCT LEVELS TO DETERMINE FURTHER ADDITIONS INVISTA Technologies S à r l (CH) 2016-07-27 EP disclosed
EP-2395010-B1 Method for the purification of triorganophosphites by treatment with a basic additive INVISTA Technologies S à r l (CH) 2016-07-13 EP disclosed
US-9221852-B2 Method for making organodiphosphites from phosphorochloridites characterized by measuring side-product levels to determine further additions INVISTA NORTH AMERICA S.A.R.L. (US) 2015-12-29 US disclosed
US-9221852-B2 Method for making organodiphosphites from phosphorochloridites characterized by measuring side-product levels to determine further additions INVISTA NORTH AMERICA S.A.R.L. (US) 2015-12-29 US disclosed
EP-2949638-A1 METHOD FOR THE PREPARATION OF 2,2 -BIPHENOLS USING SELENIUM DIOXIDE Evonik Degussa GmbH (DE) 2015-12-02 EP disclosed
US-7629484-B2 Method for the purification of triorganophosphites by treatment with a basic additive INVISTA NORTH AMERICA S.A.R.L. (US) 2009-12-08 US disclosed
US-7629484-B2 Method for the purification of triorganophosphites by treatment with a basic additive INVISTA NORTH AMERICA S.A.R.L. (US) 2009-12-08 US disclosed
EP-1905511-A2 Phosphorus-containing compositions and their use in hydrocyanation, isomerization and hydroformylation reactions INVISTA Technologies S.à.r.l. (CH) 2008-04-02 EP disclosed
WO-2007109005-A2 METHOD FOR THE PURIFICATION OF TRIORGANOPHOSPHITES BY TREATMENT WITH A BASIC ADDITIVE INVISTA TECHNOLOGIES S.A R.L. (CH) 2007-09-27 WO disclosed
US-20070219386-A1 Method for the purification of triorganophosphites by treatment with a basic additive INVISTA NORTH AMERICA S.A R.L. (US) 2007-09-20 US disclosed
US-20070219386-A1 Method for the purification of triorganophosphites by treatment with a basic additive INVISTA NORTH AMERICA S.A R.L. (US) 2007-09-20 US disclosed
US-6924345-B2 Phosphorus-containing compositions and their use in hydrocyanation, isomerization and hydroformylation reactions INVISTA NORTH AMERICA S.A R.L. (US) 2005-08-02 US disclosed
US-20040054105-A1 Phosphorus-containing compositions and their use in hydrocyanation, isomerization and hydroformylation reactions INV NYLON CHEMICALS AMERICAS, LLC 2004-03-18 US disclosed
US-6660876-B2 Ethylenically unsaturated, phosphorus-containing, bidentate ligands E. I. DU PONT DE NEMOURS AND COMPANY 2003-12-09 US disclosed
US-20030144440-A1 Phosphorus-containing compositions and their use in hydrocyanation, isomerization and hydroformylation reactions INV NYLON CHEMICALS AMERICAS, LLC 2003-07-31 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 (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-20070219386-A1 Method for the purification of triorganophosphites by treatment with a basic additive HRH3, PHOSPHO1, HRH4 GABRA1 4302/4885GABRB1 4365/4885CA1 338/4885

“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.