SCHEMBL9934703

SCHEMBL9934703

Cc1cc[n+](C[n+]2ccc(C)c3ccccc32)c2ccccc12

nearest known ligand 0.70

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.58
POLB P06746 1/20 0.58
RECQL P46063 1/20 0.57
MAPT P10636 3/20 0.52
HTT P42858 2/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
LMNA P02545 1/20 0.46
KMT2A Q03164 2/20 0.45
CYP1A2 P05177 1/20 0.42
RAB9A P51151 2/20 0.42
NPC1 O15118 1/20 0.42
MEN1 O00255 1/20 0.41
CHKA P35790 2/20 0.38

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
SCHEMBL1476988 0.86 KDM4E (0.57) KDM4EPOLBRECQLMAPTHTT
SCHEMBL14356103 0.84 KDM4E (0.59) KDM4EPOLBRECQLMAPTHTT
SCHEMBL13645489 0.84 KDM4E (0.64) KDM4EPOLBRECQLMAPTHTT
Iodide SCHEMBL1343656 0.84 KDM4E (0.56) KDM4EPOLBRECQLMAPTHTT
Bromide SCHEMBL2482814 0.84 KDM4E (0.59) KDM4EPOLBRECQLMAPTHTT
Hydrochloric Acid SCHEMBL6333321 0.84 KDM4E (0.55) KDM4EPOLBRECQLMAPTHTT
Iodide SCHEMBL29226832 0.84 KDM4E (0.55) KDM4EPOLBRECQLMAPTHTT
Iodide SCHEMBL30920085 0.84 KDM4E (0.56) KDM4EPOLBRECQLMAPTHTT
SCHEMBL61492 0.83 KDM4E (0.55) KDM4EPOLBRECQLMAPTHTT
SCHEMBL12201164 0.82 KDM4E (0.62) KDM4EPOLBRECQLMAPTHTT

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 KDM4E 4681/4885POLB 3633/4885RECQL 1079/4885

“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.