SCHEMBL1728207

SCHEMBL1728207

CCCCC(C)NS(=O)(=O)O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.45
ADH1B P00325 1/20 0.39
ADH1C P00326 1/20 0.39
ADH1A P07327 1/20 0.39
ADH4 P08319 1/20 0.39
ADH7 P40394 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.38
TAS1R3 Q7RTX0 1/20 0.38
TAS1R1 Q7RTX1 1/20 0.38
TAS1R2 Q8TE23 1/20 0.38
CA2 P00918 7/20 0.37
CA12 O43570 1/20 0.37
CA9 Q16790 1/20 0.37
DPP7 Q9UHL4 1/20 0.36
SLC15A1 P46059 1/20 0.36
FDPS P14324 1/20 0.35
CA1 P00915 5/20 0.35
MAPK1 P28482 1/20 0.34
ADRB2 P07550 2/20 0.34
MEN1 O00255 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
SCHEMBL1728198 0.94 TP53 (0.53) TP53ADH1BADH1CADH1AADH4
SCHEMBL14532481 0.94 TP53 (0.53) TP53ADH1BADH1CADH1AADH4
SCHEMBL1727806 0.92 TP53 (0.52) TP53ADH1BADH1CADH1AADH4
SCHEMBL1726632 0.92 TP53 (0.52) TP53ADH1BADH1CADH1AADH4
SCHEMBL1728177 0.92 TP53 (0.52) TP53ADH1BADH1CADH1AADH4
SCHEMBL1726872 0.86 SMN1; SMN2 (0.48) TP53SMN1; SMN2CA2CA12CA9
SCHEMBL11393625 0.81 TP53 (0.44) TP53CA2DPP7SLC15A1FDPS
SCHEMBL9888689 0.80 ADH1B (0.41) TP53ADH1BADH1CADH1AADH4
SCHEMBL21789783 0.80 ADH1B (0.41) TP53ADH1BADH1CADH1AADH4
SCHEMBL291880 0.78 ADH1B (0.39) TP53ADH1BADH1CADH1AADH4

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 TP53 589/4885ADH1B 1684/4885ADH1C 3114/4885

“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.