SCHEMBL1826352

SCHEMBL1826352

CC(C)(C)OC(=O)C(c1ccc(OS(=O)(=O)c2ccccc2)cc1)C(CN)CC(=O)OCc1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 11/20 0.42
LTA4H P09960 1/20 0.36
SLC15A1 P46059 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
ACHE P22303 1/20 0.35
KLK7 P49862 1/20 0.35
KLK5 Q9Y337 1/20 0.35
LMNA P02545 1/20 0.34
CA12 O43570 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
CDC25B P30305 1/20 0.34

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
SCHEMBL1826577 0.95 P2RX7 (0.49) P2RX7LMNA
SCHEMBL1822703 0.93 P2RX7 (0.42) P2RX7LTA4HCA1CA2ACHE
SCHEMBL1823647 0.91 ABCB1 (0.38) P2RX7CA2TDP1
SCHEMBL1825092 0.91 PPARG (0.38) P2RX7LTA4HSLC15A1CA1CA2
SCHEMBL1824647 0.91 SMN1; SMN2 (0.39) P2RX7TDP1
SCHEMBL1823638 0.90 TDP1 (0.38) P2RX7LTA4HSLC15A1CA1CA2
SCHEMBL1826134 0.90 ALDH1A1 (0.37) P2RX7TDP1
SCHEMBL1827136 0.89 P2RX7 (0.43) P2RX7LTA4HSLC15A1CA1CA2
SCHEMBL3578780 0.88 ADAMTS4 (0.36) P2RX7TDP1
SCHEMBL1824621 0.88 P2RX7 (0.49) P2RX7LMNA

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 P2RX7 3606/4885LTA4H 3852/4885SLC15A1 3789/4885
US-20070270603-A1 Process for preparing a biaryl compound CYP4A11, CYP4B1, CYP51A1 P2RX7 2747/4885LTA4H 3332/4885SLC15A1 4652/4885

“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.