SCHEMBL2830143

SCHEMBL2830143

CCOC(=O)C(C)c1ccc(OS(C)(=O)=O)cc1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CXCR2 P25025 2/20 0.45
STS P08842 1/20 0.44
CXCR1 P25024 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.43
TP53 P04637 1/20 0.43
PPARG P37231 3/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
PPARA Q07869 1/20 0.41
PTGS2 P35354 5/20 0.40
AKR1C3 P42330 1/20 0.39
AKR1C2 P52895 1/20 0.39
GAA P10253 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
ALDH1A1 P00352 1/20 0.38

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
SCHEMBL2834104 0.84 CXCR2 (0.50) CXCR2STSCXCR1TDP1PTGS2
SCHEMBL1821726 0.84 CXCR2 (0.61) CXCR2STSCXCR1SMN1; SMN2TP53
SCHEMBL2834595 0.82 PTGS1 (0.44) SMN1; SMN2PPARGMEN1KMT2ATDP1
SCHEMBL1824525 0.81 KMT2A (0.49) PPARGMEN1KMT2AGAAALDH1A1
SCHEMBL2838539 0.81 CA1 (0.51) CXCR2CXCR1PPARGPPARAALDH1A1
SCHEMBL2832246 0.81 TDP1 (0.48) SMN1; SMN2PPARGTDP1GAAALDH1A1
SCHEMBL2838485 0.80 CXCR2 (0.52) CXCR2CXCR1PTGS2AKR1C3AKR1C2
SCHEMBL1825546 0.80 CXCR2 (0.49) CXCR2STSCXCR1SMN1; SMN2PPARG
SCHEMBL490908 0.80 TDP1 (0.50) PPARGMEN1KMT2ATDP1PTGS2
SCHEMBL1825479 0.80 CXCR2 (0.47) CXCR2CXCR1SMN1; SMN2PPARGTDP1

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 7 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
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 CXCR2 1017/4885STS 625/4885CXCR1 563/4885
US-20070270603-A1 Process for preparing a biaryl compound CYP4A11, CYP4B1, CYP51A1 CXCR2 4382/4885STS 131/4885CXCR1 4543/4885

“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.