SCHEMBL4432440

SCHEMBL4432440

COCCCOCCOCCOCCCO

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
THRB P10828 1/20 0.44
HTT P42858 1/20 0.44
MAPT P10636 1/20 0.44
TSHR P16473 4/20 0.44
MAPK1 P28482 1/20 0.38
ALDH1A1 P00352 4/20 0.34
CYP3A4 P08684 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
GAA P10253 2/20 0.32
CYP4F2 P78329 1/20 0.32
CYP4A11 Q02928 1/20 0.32

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
SCHEMBL10057440 1.00 MEN1 (0.44) MEN1KMT2ATHRBHTTMAPT
SCHEMBL2270834 0.97 TSHR (0.46) MEN1KMT2ATHRBHTTMAPT
SCHEMBL24505431 0.97 TSHR (0.46) MEN1KMT2ATHRBHTTMAPT
SCHEMBL642382 0.97 TSHR (0.46) MEN1KMT2ATHRBHTTMAPT
SCHEMBL31608767 0.95 MEN1 (0.44) MEN1KMT2ATHRBHTTMAPT
SCHEMBL7977811 0.92 MEN1 (0.46) MEN1KMT2ATHRBHTTMAPT
SCHEMBL20067038 0.92 MEN1 (0.46) MEN1KMT2ATHRBHTTMAPT
SCHEMBL1071488 0.92 MEN1 (0.46) MEN1KMT2ATHRBHTTMAPT
SCHEMBL20067013 0.92 MEN1 (0.46) MEN1KMT2ATHRBHTTMAPT
SCHEMBL2399487 0.92

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
EP-2450998-A1 ELECTROLYTIC SOLUTION FOR CHARGEABLE DEVICE, ELECTROLYTIC SOLUTION FOR LITHIUM ION SECONDARY BATTERY, AND SECONDARY BATTERY Asahi Glass Company, Limited (JP) 2012-05-09 EP disclosed
US-20120107701-A1 ELECTROLYTE SOLUTION FOR CHARGEABLE DEVICE, ELECTROLYTE SOLUTION FOR LITHIUM ION SECONDARY BATTERY, AND SECONDARY BATTERY ASAHI GLASS COMPANY, LIMITED (JP) 2012-05-03 US disclosed
US-20120107701-A1 ELECTROLYTE SOLUTION FOR CHARGEABLE DEVICE, ELECTROLYTE SOLUTION FOR LITHIUM ION SECONDARY BATTERY, AND SECONDARY BATTERY ASAHI GLASS COMPANY, LIMITED (JP) 2012-05-03 US disclosed