SCHEMBL5488936

SCHEMBL5488936

CCCCn1cc[n+](C)c1.O=S(=O)([O-])OCC(F)(F)C(F)(F)C(F)(F)F

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.46
HSP90AA1 P07900 2/20 0.46
KMT2A Q03164 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
APAF1 O14727 1/20 0.46
NPC1 O15118 1/20 0.46
PLA2G1B P04054 1/20 0.46
MAPT P10636 1/20 0.46
MAPK1 P28482 1/20 0.46
HTT P42858 1/20 0.46
RAB9A P51151 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
ATG4B Q9Y4P1 1/20 0.46
FDPS P14324 14/20 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
SCHEMBL5484712 0.96 MEN1 (0.44) MEN1HSP90AA1KMT2ASMN1; SMN2APAF1
SCHEMBL2939877 0.83 MAPK1 (0.45) MEN1HSP90AA1KMT2ASMN1; SMN2APAF1
SCHEMBL1617966 0.81 MEN1 (0.56) MEN1HSP90AA1KMT2ASMN1; SMN2APAF1
SCHEMBL1172285 0.81 MEN1 (0.50) MEN1HSP90AA1KMT2ASMN1; SMN2APAF1
SCHEMBL1416717 0.80 MAPK1 (0.55) MEN1HSP90AA1KMT2ASMN1; SMN2APAF1
Trifluoromethanesulfonic Acid SCHEMBL294105 0.80 MEN1 (0.58) MEN1HSP90AA1KMT2ASMN1; SMN2APAF1
Trifluoromethanesulfonic Acid SCHEMBL29390371 0.80 MEN1 (0.58) MEN1HSP90AA1KMT2ASMN1; SMN2APAF1
SCHEMBL5484656 0.80 ACHE (0.32) MEN1KMT2A
Amylosulfuric Acid SCHEMBL5486551 0.79 MAPK1 (0.57) MEN1HSP90AA1KMT2ASMN1; SMN2APAF1
SCHEMBL305739 0.79 MEN1 (0.59) MEN1HSP90AA1KMT2ASMN1; SMN2APAF1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070219379-A1 Ionic Liquid and Process for Producing the Same KANEKA CORPORATION (JP) 2007-09-20 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-20070219379-A1 Ionic Liquid and Process for Producing the Same HCN4, HCN2, HCN3 MEN1 3967/4885HSP90AA1 4174/4885KMT2A 3010/4885

“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.