SCHEMBL1825205

SCHEMBL1825205

CCOC(=O)CC(Cc1ccc(OS(C)(=O)=O)cc1)NC(=O)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CASP3 P42574 4/20 0.48
PPARG P37231 2/20 0.39
PPARA Q07869 1/20 0.39
PTPN1 P18031 1/20 0.39
KMT2A Q03164 1/20 0.39
MMEL1 Q495T6 1/20 0.37
EPHX2 P34913 1/20 0.37
MDM2 Q00987 1/20 0.36

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
SCHEMBL1827683 0.93 CASP3 (0.49) CASP3PTPN1KMT2AEPHX2MDM2
SCHEMBL1826534 0.91 CASP3 (0.49) CASP3PPARGPPARAPTPN1
SCHEMBL1824615 0.90 CASP3 (0.47) CASP3PPARGPPARAPTPN1
SCHEMBL1828573 0.90 CASP3 (0.47) CASP3PTPN1KMT2AEPHX2MDM2
SCHEMBL1825274 0.89 CASP3 (0.47) CASP3PTPN1
SCHEMBL1824623 0.89 P2RX7 (0.44) CASP3
SCHEMBL1826644 0.86 CASP3 (0.48) CASP3PPARGPPARAPTPN1MDM2
SCHEMBL1826643 0.86 CASP3 (0.48) CASP3PPARGPPARAPTPN1MDM2
SCHEMBL1827054 0.86 CASP3 (0.42) CASP3PPARGPPARAPTPN1KMT2A
SCHEMBL1823607 0.85 CASP3 (0.49) CASP3KMT2AEPHX2

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 CASP3 1512/4885PPARG 3864/4885PPARA 3865/4885
US-20070270603-A1 Process for preparing a biaryl compound CYP4A11, CYP4B1, CYP51A1 CASP3 854/4885PPARG 2131/4885PPARA 2339/4885

“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.