SCHEMBL3570718

SCHEMBL3570718

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

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 12/20 0.49
SYK P43405 1/20 0.48
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
ACHE P22303 1/20 0.42
MAPT P10636 2/20 0.42
CTSK P43235 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
PSMB5 P28074 1/20 0.39

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
SCHEMBL1822915 0.94 P2RX7 (0.57) P2RX7SYKMAPT
SCHEMBL1823128 0.92 SYK (0.51) P2RX7SYKCA1CA2ACHE
SCHEMBL1827842 0.91 EGFR (0.43) P2RX7SYKCA1CA2CTSK
SCHEMBL1824993 0.90 SYK (0.53) P2RX7SYKCA1CA2ACHE
SCHEMBL1828035 0.90 CA1 (0.47) P2RX7CA1CA2ACHEMAPT
SCHEMBL1824618 0.90 CA1 (0.44) P2RX7CA1CA2ACHEMAPT
SCHEMBL1825084 0.90 SYK (0.46) P2RX7SYKCA1MAPTCTSK
SCHEMBL1825827 0.88 HSD17B10 (0.45) P2RX7SYKCA1CA2ACHE
SCHEMBL1825193 0.87 CA1 (0.45) P2RX7CA1CA2ACHECTSK
SCHEMBL3574127 0.87 P2RX7 (0.55) P2RX7SYKMAPT

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7714157-B2 Process for preparing a biaryl compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-05-11 US 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 3606/4885SYK 1520/4885CA1 1603/4885
US-20070270603-A1 Process for preparing a biaryl compound CYP4A11, CYP4B1, CYP51A1 P2RX7 2747/4885SYK 1172/4885CA1 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.