SCHEMBL1824834

SCHEMBL1824834

CC(C)OC(=O)C(c1ccc(OS(=O)(=O)c2ccccc2)cc1)C(N)C(=O)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CASP3 P42574 4/20 0.38
SMN1; SMN2 Q16637 2/20 0.36
ALDH1A1 P00352 1/20 0.36
ADAMTS4 O75173 1/20 0.36
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
KMT2A Q03164 1/20 0.35
FABP5 Q01469 2/20 0.34
MAPT P10636 2/20 0.34
FABP7 O15540 1/20 0.34
TDP1 Q9NUW8 2/20 0.34
ENPP3 O14638 1/20 0.33
ENPP1 P22413 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 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
SCHEMBL1825714 0.94 ENPP2 (0.37) CASP3ALDH1A1CA1CA2KMT2A
SCHEMBL1824575 0.91 CASP3 (0.37) CASP3CA1CA2KMT2AFABP5
SCHEMBL1824545 0.91 CASP3 (0.41) CASP3SMN1; SMN2ALDH1A1ADAMTS4CA1
SCHEMBL1828565 0.90 CASP3 (0.38) CASP3SMN1; SMN2ALDH1A1ADAMTS4CA1
SCHEMBL1826829 0.90 CASP3 (0.38) CASP3CA1CA2KMT2AFABP5
SCHEMBL1822320 0.88 BACE1 (0.38) CASP3SMN1; SMN2ALDH1A1CA1CA2
SCHEMBL1827853 0.87 CASP3 (0.37) CASP3SMN1; SMN2ALDH1A1ADAMTS4CA1
SCHEMBL1823201 0.87 CASP3 (0.38) CASP3SMN1; SMN2CA1CA2KMT2A
SCHEMBL1827475 0.86 CASP3 (0.38) CASP3SMN1; SMN2ALDH1A1ADAMTS4CA1
SCHEMBL1823730 0.86 CASP3 (0.38) CASP3SMN1; SMN2ALDH1A1ADAMTS4CA1

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 1512/4885SMN1; SMN2 2274/4885ALDH1A1 1099/4885
US-20070270603-A1 Process for preparing a biaryl compound CYP4A11, CYP4B1, CYP51A1 CASP3 854/4885SMN1; SMN2 3216/4885ALDH1A1 1440/4885

“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.