SCHEMBL1824697

SCHEMBL1824697

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

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ENPP3 O14638 1/20 0.36
ENPP1 P22413 1/20 0.36
CXCR2 P25025 2/20 0.35
HTT P42858 1/20 0.35
STS P08842 1/20 0.35
ALDH1A1 P00352 4/20 0.35
CXCR1 P25024 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.34
CA1 P00915 2/20 0.34
CA2 P00918 2/20 0.34
CA9 Q16790 2/20 0.34
CA12 O43570 1/20 0.34
PPARA Q07869 4/20 0.33
PPARG P37231 2/20 0.33
POLB P06746 1/20 0.33
MAPT P10636 1/20 0.33
PKM P14618 1/20 0.33
CYP3A4 P08684 1/20 0.33
KDM4E B2RXH2 1/20 0.33
HPGD P15428 1/20 0.33

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
SCHEMBL1824763 0.82 TDP1 (0.47) ENPP3ENPP1ALDH1A1SMN1; SMN2CA2
SCHEMBL1825138 0.81 KMT2A (0.47) ENPP3ENPP1HTTALDH1A1CA2
SCHEMBL1823950 0.81 MMP2 (0.36) ENPP3ENPP1CXCR2HTTSTS
SCHEMBL1824696 0.80 ALDH1A1 (0.42) ENPP3ENPP1CXCR2HTTSTS
SCHEMBL1822914 0.80 ALDH1A1 (0.41) ENPP3ENPP1CXCR2STSALDH1A1
SCHEMBL15019127 0.80 MEN1 (0.43) ALDH1A1SMN1; SMN2POLBMAPTPKM
SCHEMBL1824132 0.77 ALDH1A1 (0.41) ENPP3ENPP1CXCR2HTTSTS
SCHEMBL1824737 0.77 HPGD (0.36) ENPP3ENPP1CXCR2HTTSTS
SCHEMBL1826046 0.77 CXCR2 (0.39) ENPP3ENPP1CXCR2HTTSTS
SCHEMBL1828326 0.76 ALDH1A1 (0.41) ENPP3ENPP1CXCR2HTTSTS

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 ENPP3 3529/4885ENPP1 3768/4885CXCR2 1017/4885
US-20070270603-A1 Process for preparing a biaryl compound CYP4A11, CYP4B1, CYP51A1 ENPP3 1984/4885ENPP1 2849/4885CXCR2 4382/4885

“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.