SCHEMBL1826147

SCHEMBL1826147

CS(=O)(=O)Oc1ccc(C(C(=O)OCC2c3ccccc3-c3ccccc32)C(CN)C(=O)OCc2ccccc2)cc1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.39
CASP3 P42574 3/20 0.38
CA1 P00915 2/20 0.36
CA2 P00918 2/20 0.36
ACHE P22303 1/20 0.36
FABP5 Q01469 3/20 0.35
PPARG P37231 3/20 0.35
HDAC1 Q13547 1/20 0.35
HDAC2 Q92769 1/20 0.35
FABP7 O15540 2/20 0.34
PPARA Q07869 3/20 0.33
ALOX5 P09917 1/20 0.33
IDO1 P14902 1/20 0.33
PTPN1 P18031 1/20 0.33
ELANE P08246 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
SCHEMBL1826972 0.90 KMT2A (0.38) KMT2ACASP3CA1CA2ACHE
SCHEMBL1825603 0.90 KMT2A (0.38) KMT2ACASP3CA1CA2FABP5
SCHEMBL1825038 0.89 CASP3 (0.39) KMT2ACASP3CA1CA2ACHE
SCHEMBL1825033 0.89 KMT2A (0.41) KMT2ACASP3CA1CA2FABP5
SCHEMBL1824917 0.88 CA1 (0.43) CA1CA2ACHEPPARGPPARA
SCHEMBL3569742 0.88 P2RX7 (0.40) KMT2ACA1CA2PPARG
SCHEMBL1824903 0.87 KMT2A (0.38) KMT2ACASP3CA1CA2FABP5
SCHEMBL1824786 0.87 CASP3 (0.38) KMT2ACASP3CA1CA2ACHE
SCHEMBL1821559 0.86 KMT2A (0.37) KMT2ACASP3CA1CA2FABP5
SCHEMBL1826536 0.85 CASP3 (0.39) KMT2ACASP3CA1CA2ACHE

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 KMT2A 1068/4885CASP3 1512/4885CA1 1603/4885
US-20070270603-A1 Process for preparing a biaryl compound CYP4A11, CYP4B1, CYP51A1 KMT2A 1084/4885CASP3 854/4885CA1 1728/4885

“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.