SCHEMBL1728267

SCHEMBL1728267

CCCCCCCC(C)(C)NS(=O)(=O)O

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.41
CA2 P00918 2/20 0.41
EPHX1 P07099 4/20 0.41
GGPS1 O95749 6/20 0.39
PPARA Q07869 2/20 0.39
FDPS P14324 9/20 0.38
CES2 O00748 1/20 0.37
LPAR1 Q92633 1/20 0.37
LPAR3 Q9UBY5 1/20 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
SCHEMBL1726842 1.00 CA1 (0.41) CA1CA2EPHX1GGPS1PPARA
SCHEMBL1727784 0.98 CA1 (0.38) CA1CA2EPHX1GGPS1PPARA
SCHEMBL1726736 0.92 CA2 (0.35) CA1CA2EPHX1PPARAFDPS
SCHEMBL27884083 0.82 FDPS (0.41) CA1CA2EPHX1GGPS1PPARA
SCHEMBL17520383 0.82 EPHX1 (0.37) CA1CA2EPHX1GGPS1PPARA
SCHEMBL18214479 0.82 EPHX1 (0.37) CA1CA2EPHX1GGPS1PPARA
SCHEMBL17520395 0.82 EPHX1 (0.37) CA1CA2EPHX1GGPS1PPARA
SCHEMBL10486694 0.81 CA1 (0.39) CA1CA2EPHX1GGPS1PPARA
Sulfuric Acid SCHEMBL27506935 0.80 CA1 (0.41) CA1CA2EPHX1GGPS1PPARA
SCHEMBL21324287 0.80 EPHX1 (0.40) CA1CA2EPHX1GGPS1PPARA

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-8921124-B2 Pyrazole-based cyanine dye WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 2014-12-30 US disclosed
WO-2012033298-A3 METHOD FOR MANUFACTURING A NOX GAS SENSOR, AND NOX GAS SENSOR MANUFACTURED USING SAME 일진머티리얼즈 주식회사 (KR) 2012-05-10 WO disclosed
EP-2006289-B1 PYRAZOLE-TYPE CYANINE DYE WAKO PURE CHEM IND LTD (JP) 2011-11-30 EP disclosed
US-20090069546-A1 PYRAZOLE-BASED CYANINE DYE WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 2009-03-12 US disclosed
EP-2006289-A1 PYRAZOLE-TYPE CYANINE DYE Wako Pure Chemical Industries, Ltd. (JP) 2008-12-24 EP 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 (1 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-20090069546-A1 PYRAZOLE-BASED CYANINE DYE CBR3, CYB5R3, TST CA1 221/4885CA2 31/4885EPHX1 4588/4885

“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.