SCHEMBL1823955

SCHEMBL1823955

CCOC(=O)C(CNC(=O)OC(C)(C)C)c1cccc(OS(C)(=O)=O)c1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SYK P43405 1/20 0.41
IDH1 O75874 1/20 0.36
NQO2 P16083 1/20 0.35
SERPINE1 P05121 1/20 0.35
HPGD P15428 1/20 0.35
GFER P55789 1/20 0.35
HSD17B10 Q99714 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
CA1 P00915 3/20 0.34
CA2 P00918 3/20 0.34
CA12 O43570 2/20 0.34
CA9 Q16790 2/20 0.34
CTSS P25774 1/20 0.34
CTSK P43235 1/20 0.34
MMP13 P45452 1/20 0.34
SCN9A Q15858 1/20 0.34
MALT1 Q9UDY8 1/20 0.34
ACACB O00763 1/20 0.34
AAK1 Q2M2I8 1/20 0.34

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
SCHEMBL1820861 0.93 SYK (0.41) SYKNQO2SERPINE1GFERHSD17B10
SCHEMBL1825407 0.92 SYK (0.40) SYKNQO2SERPINE1GFERHSD17B10
SCHEMBL1828395 0.89 SYK (0.39) SYKNQO2SERPINE1GFERHSD17B10
SCHEMBL1826055 0.88 SYK (0.41) SYKL3MBTL1CA1CA2CA12
SCHEMBL1826404 0.88 SYK (0.53) SYKL3MBTL1CA1CA2CA12
SCHEMBL1823113 0.87 P2RX7 (0.39) SYKHPGDCA1CA2CA12
SCHEMBL1823821 0.87 SYK (0.42) SYKIDH1SERPINE1HPGDCA1
SCHEMBL1824596 0.86 MTNR1A (0.43) HPGDCA1CA2CA12CA9
SCHEMBL1821109 0.85 SYK (0.39) SYKNQO2GFERHSD17B10L3MBTL1
SCHEMBL1828123 0.84 MTNR1A (0.42)

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 SYK 1520/4885IDH1 77/4885NQO2 96/4885
US-20070270603-A1 Process for preparing a biaryl compound CYP4A11, CYP4B1, CYP51A1 SYK 1172/4885IDH1 195/4885NQO2 2019/4885

“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.