SCHEMBL9936254

SCHEMBL9936254

C=CCS(=O)(=O)[O-].C=CCS(=O)(=O)[O-].Cc1ccc[n+](C[n+]2cccc(C)c2)c1

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.40
GGPS1 O95749 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
PABPC1 P11940 1/20 0.40
KMT2A Q03164 1/20 0.40
ATM Q13315 1/20 0.40
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
GFER P55789 1/20 0.35
RAB9A P51151 1/20 0.35
HTT P42858 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
SCHEMBL9936107 0.92 LMNA (0.40) LMNAGGPS1L3MBTL1PABPC1KMT2A
SCHEMBL9935131 0.80 C5AR1 (0.30)
SCHEMBL6114429 0.79 PABPC1 (0.50) LMNAGGPS1L3MBTL1PABPC1KMT2A
SCHEMBL9935254 0.78 PABPC1 (0.30) PABPC1
SCHEMBL1461724 0.75 LMNA (0.45) LMNAGGPS1L3MBTL1PABPC1KMT2A
SCHEMBL15174190 0.74 PABPC1 (0.44) LMNAGGPS1L3MBTL1PABPC1KMT2A
SCHEMBL9935707 0.73
SCHEMBL9936116 0.73 HTT (0.33) L3MBTL1KMT2AKDM4EALDH1A1HTT
SCHEMBL9934636 0.73 ACHE (0.34) L3MBTL1KMT2AKDM4EALDH1A1
SCHEMBL9934761 0.73 BCHE (0.37) 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 LMNA 3421/4885GGPS1 2730/4885L3MBTL1 204/4885

“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.