SCHEMBL1823008

SCHEMBL1823008

CC(C)(C)OC(=O)CC(c1ccc(OS(C)(=O)=O)cc1)C(N)C(=O)OCc1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PPARG P37231 3/20 0.40
CA2 P00918 2/20 0.39
CA1 P00915 1/20 0.39
ACHE P22303 1/20 0.39
LTA4H P09960 2/20 0.39
SYK P43405 1/20 0.38
SLC15A1 P46059 1/20 0.38
PPARA Q07869 3/20 0.37
ABCB1 P08183 1/20 0.37
LAP3 P28838 1/20 0.36
PRKCA P17252 1/20 0.36
PRKCD Q05655 1/20 0.36
P2RX7 Q99572 5/20 0.36
CA9 Q16790 1/20 0.35

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
SCHEMBL1827379 0.92 SLC15A1 (0.42) PPARGCA2CA1ACHELTA4H
SCHEMBL1824370 0.91 SLC15A1 (0.46) PPARGCA2CA1ACHELTA4H
SCHEMBL1825854 0.90 P2RX7 (0.43) CA2CA1ACHELTA4HSLC15A1
SCHEMBL1828934 0.89 KMT2A (0.41) PPARGCA2LTA4HSYKSLC15A1
SCHEMBL1824254 0.89 CA1 (0.45) PPARGCA2CA1ACHELTA4H
SCHEMBL1824127 0.88 PPARG (0.45) PPARGCA2CA1ACHELTA4H
SCHEMBL1825141 0.87 ALDH1A1 (0.34) PPARGCA2CA1ABCB1CA9
SCHEMBL1821114 0.87 P2RX7 (0.50) P2RX7
SCHEMBL1824705 0.87 CA1 (0.41) PPARGCA2CA1ACHELTA4H
SCHEMBL1824338 0.86 CA2 (0.39) PPARGCA2CA1ACHELTA4H

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2161254-B1 Intermediate for preparing a biaryl compound SUMITOMO CHEMICAL CO (JP) 2014-08-13 EP disclosed
EP-1481967-B1 PROCESS FOR THE PREPARATION OF BIARYL COMPOUNDS SUMITOMO CHEMICAL CO (JP) 2011-05-04 EP disclosed
US-7714157-B2 Process for preparing a biaryl compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-05-11 US disclosed
EP-2161254-A1 Intermediate for preparing a biaryl compound Sumitomo Chemical Company, Limited (JP) 2010-03-10 EP disclosed
US-20070270603-A1 Process for preparing a biaryl compound SUMITOMO CHEMICAL COMPANY, LIMITED 2007-11-22 US disclosed
US-7271280-B2 Process for preparing a biaryl compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-09-18 US disclosed
EP-1481967-A1 PROCESS FOR THE PREPARATION OF BIARYL COMPOUNDS Sumitomo Chemical Company, Limited (JP) 2004-12-01 EP disclosed
US-20040158093-A1 Process for preparing a biaryl compound SUMITOMO CHEMICAL COMPANY, LIMITED 2004-08-12 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-20040158093-A1 Process for preparing a biaryl compound CYP1B1, REL, CYP2F1 PPARG 3864/4885CA2 730/4885CA1 1603/4885
US-20070270603-A1 Process for preparing a biaryl compound CYP4A11, CYP4B1, CYP51A1 PPARG 2131/4885CA2 349/4885CA1 1728/4885

“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.