SCHEMBL1823652

SCHEMBL1823652

NC(CC(=O)OCc1ccccc1)C(Cc1ccccc1)c1ccc(OS(=O)(=O)c2ccccc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SLC15A1 P46059 2/20 0.45
LTA4H P09960 2/20 0.42
LAP3 P28838 1/20 0.42
P2RX7 Q99572 14/20 0.42
TDP1 Q9NUW8 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
SCHEMBL3575200 0.93 P2RX7 (0.51) SLC15A1P2RX7
SCHEMBL1826378 0.92 SLC15A1 (0.47) SLC15A1LTA4HLAP3P2RX7TDP1
SCHEMBL1823805 0.91 SMN1; SMN2 (0.41) P2RX7TDP1
SCHEMBL1826292 0.88 PPARG (0.47) SLC15A1LTA4HLAP3
SCHEMBL1823667 0.88 PLA2G1B (0.42) LTA4HP2RX7TDP1
SCHEMBL1823020 0.88 P2RX7 (0.41) SLC15A1P2RX7TDP1
SCHEMBL1826308 0.86 TSHR (0.40) P2RX7TDP1
SCHEMBL3577447 0.86 SLC15A1 (0.41) SLC15A1LTA4HLAP3P2RX7TDP1
SCHEMBL1825144 0.86 SLC15A1 (0.42) SLC15A1LTA4HLAP3P2RX7TDP1
SCHEMBL1822272 0.86 P2RX7 (0.46) P2RX7

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 SLC15A1 3789/4885LTA4H 3852/4885LAP3 4413/4885
US-20070270603-A1 Process for preparing a biaryl compound CYP4A11, CYP4B1, CYP51A1 SLC15A1 4652/4885LTA4H 3332/4885LAP3 2586/4885

“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.