SCHEMBL1824955

SCHEMBL1824955

COC(CNC(=O)OC(C)(C)C)c1ccccc1OS(C)(=O)=O

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SYK P43405 1/20 0.42
MALT1 Q9UDY8 1/20 0.39
DRD2 P14416 5/20 0.39
CA12 O43570 2/20 0.38
CA1 P00915 2/20 0.38
CA7 P43166 1/20 0.38
CA14 Q9ULX7 1/20 0.38
EPHX2 P34913 1/20 0.36
KDM4A O75164 1/20 0.36
NQO2 P16083 1/20 0.35
ATM Q13315 1/20 0.35
CA2 P00918 1/20 0.35
CA9 Q16790 1/20 0.35
CTSS P25774 1/20 0.35
CTSK P43235 1/20 0.35
ITGAV P06756 1/20 0.35
PCSK9 Q8NBP7 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
SCHEMBL1826401 0.89 SYK (0.41) SYKMALT1DRD2CA12CA1
SCHEMBL1823905 0.88 SYK (0.40) SYKMALT1DRD2CA12CA1
SCHEMBL1824624 0.86 SYK (0.51) SYKMALT1CA12CA1CA7
SCHEMBL1826410 0.86 SYK (0.44) SYKMALT1DRD2CA12CA1
SCHEMBL1826107 0.85 LMNA (0.40) SYKCA12CA1CA2CA9
SCHEMBL1826344 0.79 CA12 (0.41) SYKMALT1CA12CA1CA7
SCHEMBL1822239 0.77 SYK (0.39) SYKMALT1CA12CA1KDM4A
SCHEMBL3575086 0.77 SYK (0.39) SYKMALT1CA12CA1CA7
SCHEMBL1822504 0.76 SYK (0.47) SYKCA12CA1CA7CA14
SCHEMBL1825628 0.75 LMNA (0.39) SYK

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 1520/4885MALT1 155/4885DRD2 943/4885
US-20070270603-A1 Process for preparing a biaryl compound CYP4A11, CYP4B1, CYP51A1 SYK 1172/4885MALT1 477/4885DRD2 2825/4885

“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.