SCHEMBL1826541

SCHEMBL1826541

CC(C)OC(=O)C(CNC(=O)OCc1ccccc1)Cc1ccc(OS(C)(=O)=O)cc1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PPARG P37231 3/20 0.47
PTPN1 P18031 1/20 0.46
CA1 P00915 5/20 0.44
CA2 P00918 5/20 0.44
ACHE P22303 4/20 0.44
PPARA Q07869 3/20 0.44
MAPT P10636 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
SYK P43405 1/20 0.41
CA12 O43570 1/20 0.40
CA9 Q16790 1/20 0.40
CTSL P07711 2/20 0.40
CTSS P25774 2/20 0.40
CTSK P43235 2/20 0.40
ACE2 Q9BYF1 1/20 0.40
CTSB P07858 1/20 0.40

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
SCHEMBL1824916 0.92 PPARG (0.50) PPARGPTPN1CA1CA2ACHE
SCHEMBL1827040 0.91 PPARG (0.49) PPARGPTPN1CA1CA2ACHE
SCHEMBL1824540 0.90 P2RX7 (0.47) PTPN1MAPTL3MBTL1
SCHEMBL1826715 0.89 PPARG (0.53) PPARGPTPN1CA1CA2ACHE
SCHEMBL1828002 0.87 SYK (0.52) PPARGPTPN1PPARAMAPTL3MBTL1
SCHEMBL3576717 0.87 P2RX7 (0.55) PTPN1MAPT
SCHEMBL3573362 0.85 PPARG (0.45) PPARGPTPN1CA1CA2ACHE
SCHEMBL1826212 0.84 CA1 (0.49) CA1CA2ACHEMAPTL3MBTL1
SCHEMBL3578129 0.84 PPARG (0.42) PPARGCA2PPARACA12CA9
SCHEMBL1828756 0.84 PPARG (0.43) PPARGPPARA

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 3864/4885PTPN1 963/4885CA1 1603/4885
US-20070270603-A1 Process for preparing a biaryl compound CYP4A11, CYP4B1, CYP51A1 PPARG 2131/4885PTPN1 4064/4885CA1 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.