SCHEMBL1825313

SCHEMBL1825313

COC(=O)C(Cc1ccc(OS(=O)(=O)c2ccc(C)cc2)cc1)NCc1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ATM Q13315 2/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
P2RX7 Q99572 11/20 0.54
CA12 O43570 2/20 0.48
CA9 Q16790 2/20 0.48
CA7 P43166 1/20 0.48
CA14 Q9ULX7 1/20 0.48
KDM4E B2RXH2 1/20 0.48
KDM4A O75164 1/20 0.48
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
MMP2 P08253 1/20 0.45
MMP9 P14780 1/20 0.45

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
SCHEMBL1825315 1.00 ATM (0.56) ATML3MBTL1P2RX7CA12CA9
SCHEMBL1825841 0.93 CA12 (0.52) ATML3MBTL1P2RX7CA12CA9
SCHEMBL1825842 0.93 CA12 (0.52) ATML3MBTL1P2RX7CA12CA9
SCHEMBL1821507 0.93 P2RX7 (0.54) ATML3MBTL1P2RX7KDM4EKDM4A
SCHEMBL1821509 0.93 P2RX7 (0.54) ATML3MBTL1P2RX7KDM4EKDM4A
SCHEMBL1825375 0.92 P2RX7 (0.59) ATML3MBTL1P2RX7
SCHEMBL1825374 0.92 P2RX7 (0.59) ATML3MBTL1P2RX7
SCHEMBL7341316 0.91 KDM4E (0.54) ATML3MBTL1P2RX7KDM4EKDM4A
SCHEMBL1822315 0.91 P2RX7 (0.52) ATML3MBTL1P2RX7KDM4EKDM4A
SCHEMBL1822316 0.91 P2RX7 (0.52) ATML3MBTL1P2RX7KDM4EKDM4A

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 ATM 4601/4885L3MBTL1 2772/4885P2RX7 3606/4885
US-20070270603-A1 Process for preparing a biaryl compound CYP4A11, CYP4B1, CYP51A1 ATM 4386/4885L3MBTL1 4827/4885P2RX7 2747/4885

“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.