SCHEMBL1827773

SCHEMBL1827773

COC(=O)CC(N)(C(=O)OC(C)(C)C)c1ccc(OS(=O)(=O)c2ccccc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.41
MEN1 O00255 1/20 0.41
MAPT P10636 1/20 0.41
RECQL P46063 1/20 0.41
KMT2A Q03164 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
ENPP1 P22413 7/20 0.40
ENPP3 O14638 6/20 0.40
KDM4E B2RXH2 1/20 0.39
KDM4A O75164 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
ADAMTS4 O75173 1/20 0.38
P2RX7 Q99572 6/20 0.38
EGFR P00533 1/20 0.38
ENPP2 Q13822 3/20 0.37

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
SCHEMBL1826492 0.93 TDP1 (0.41) ALDH1A1MEN1MAPTRECQLKMT2A
SCHEMBL1820860 0.90 PPARG (0.43) ALDH1A1MEN1MAPTRECQLKMT2A
SCHEMBL1827341 0.89 HSD11B1 (0.45) ALDH1A1MEN1MAPTRECQLKMT2A
SCHEMBL1826248 0.89 ADAMTS4 (0.39) ALDH1A1MEN1MAPTRECQLKMT2A
SCHEMBL1823240 0.88 P2RX7 (0.44) ALDH1A1MEN1MAPTRECQLKMT2A
SCHEMBL1823948 0.85 CA2 (0.35) ALDH1A1MEN1MAPTRECQLKMT2A
SCHEMBL1825257 0.85 P2RX7 (0.40) ALDH1A1MEN1MAPTRECQLKMT2A
SCHEMBL1827658 0.83 PPARG (0.42) ALDH1A1MEN1MAPTRECQLKMT2A
SCHEMBL1823092 0.83 P2RX7 (0.44) ALDH1A1MEN1MAPTRECQLKMT2A
SCHEMBL1826498 0.82 P2RX7 (0.51) ALDH1A1MAPTP2RX7

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 ALDH1A1 1099/4885MEN1 421/4885MAPT 4712/4885
US-20070270603-A1 Process for preparing a biaryl compound CYP4A11, CYP4B1, CYP51A1 ALDH1A1 1440/4885MEN1 183/4885MAPT 2237/4885

“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.