SCHEMBL9934761

SCHEMBL9934761

C=CCS(=O)(=O)[O-].C=CCS(=O)(=O)[O-].c1cc[n+](CC[n+]2ccccc2)cc1

nearest known ligand 0.37

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
BCHE P06276 7/20 0.37
ACHE P22303 7/20 0.37
PABPC1 P11940 1/20 0.36
EIF4H Q15056 1/20 0.36
CTDSP1 Q9GZU7 1/20 0.36

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
SCHEMBL9936070 0.93 BCHE (0.48) BCHEACHE
SCHEMBL9935379 0.93 BCHE (0.43) BCHEACHEPABPC1EIF4HCTDSP1
SCHEMBL9935254 0.90 PABPC1 (0.30) PABPC1EIF4HCTDSP1
SCHEMBL9934503 0.90 ACHE (0.39) BCHEACHEPABPC1EIF4HCTDSP1
SCHEMBL9935729 0.87
SCHEMBL9935545 0.87 ACHE (0.49) BCHEACHE
SCHEMBL9935707 0.85
Benzene SCHEMBL28038032 0.81 CA12 (0.35)
SCHEMBL9935992 0.81 HDAC8 (0.33)
SCHEMBL9936107 0.79 LMNA (0.40) PABPC1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8546609-B2 Ionic liquid containing allylsulfonate anion WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 2013-10-01 US disclosed
EP-2474527-A1 IONIC LIQUID CONTAINING ALLYLSULFONATE ANION Wako Pure Chemical Industries, Ltd. (JP) 2012-07-11 EP disclosed
US-20120157680-A1 IONIC LIQUID CONTAINING ALLYLSULFONATE ANION WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 2012-06-21 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 (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-20120157680-A1 IONIC LIQUID CONTAINING ALLYLSULFONATE ANION ATXN2L, ARL1, INPPL1 BCHE 4876/4885ACHE 4640/4885PABPC1 1839/4885

“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.