SCHEMBL1728087

SCHEMBL1728087

CC(C)(C)CCCCCCNS(=O)(=O)O

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GRIA1 P42261 3/20 0.40
CA2 P00918 5/20 0.39
CA1 P00915 4/20 0.39
EPHX1 P07099 1/20 0.38
PPARA Q07869 4/20 0.38
CA12 O43570 2/20 0.33
CA7 P43166 2/20 0.33
CA14 Q9ULX7 2/20 0.33
CA9 Q16790 1/20 0.33
ALDH1A1 P00352 2/20 0.31
KDM4E B2RXH2 1/20 0.31
LMNA P02545 1/20 0.31
PKM P14618 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
FFAR1 O14842 1/20 0.31
CPT2 P23786 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
RECQL P46063 1/20 0.31

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
SCHEMBL1728208 0.98 GRIA1 (0.37) GRIA1CA2CA1EPHX1PPARA
SCHEMBL1728200 0.93 GRIA1 (0.37) GRIA1CA2CA1EPHX1PPARA
SCHEMBL1726929 0.84 PDK1 (0.32) GRIA1CA2CA1
SCHEMBL2591695 0.82 PDK1 (0.31)
SCHEMBL2588015 0.82 PDK1 (0.31)
SCHEMBL4762588 0.80 POLB (0.41) GRIA1CA2CA1EPHX1PPARA
SCHEMBL28710562 0.77 CA1 (0.30) CA2CA1
SCHEMBL29229351 0.75 GRIA1 (0.42) GRIA1CA2CA1EPHX1PPARA
Sulfuric Acid SCHEMBL28687843 0.75 CA5A (0.40) ALDH1A1FFAR1CPT2TDP1
SCHEMBL21690624 0.75 CA1 (0.40) GRIA1CA2CA1EPHX1PPARA

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 GRIA1 783/4885CA2 31/4885CA1 221/4885

“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.