SCHEMBL3369707

SCHEMBL3369707

CCCCCC[N+](C)(CCCCC)CCCCCC.CCCCCC[N+](C)(CCCCCC)CCCCCC

nearest known ligand 0.67

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 10/20 0.67
HTT P42858 2/20 0.67
SLC22A1 O15245 1/20 0.65
ALDH1A1 P00352 1/20 0.61
TP53 P04637 1/20 0.61
CYP3A4 P08684 1/20 0.61
ALOX15 P16050 1/20 0.61
TSHR P16473 1/20 0.61
ALOX12 P18054 1/20 0.61
SMN1; SMN2 Q16637 1/20 0.61
HIF1A Q16665 1/20 0.61
HSD17B10 Q99714 1/20 0.61
LSS P48449 1/20 0.60
KMT2A Q03164 1/20 0.60

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
SCHEMBL3857937 1.00 DNM1 (0.67) DNM1HTTSLC22A1ALDH1A1TP53
SCHEMBL2012703 1.00 DNM1 (0.67) DNM1HTTSLC22A1ALDH1A1TP53
SCHEMBL508824 1.00 DNM1 (0.67) DNM1HTTSLC22A1ALDH1A1TP53
SCHEMBL5299524 1.00 DNM1 (0.67) DNM1HTTSLC22A1ALDH1A1TP53
SCHEMBL15762688 1.00 DNM1 (0.67) DNM1HTTSLC22A1ALDH1A1TP53
SCHEMBL638660 1.00 DNM1 (0.67) DNM1HTTSLC22A1ALDH1A1TP53
SCHEMBL4197957 1.00 DNM1 (0.67) DNM1HTTSLC22A1ALDH1A1TP53
SCHEMBL11103002 1.00 DNM1 (0.67) DNM1HTTSLC22A1ALDH1A1TP53
SCHEMBL3309839 1.00 DNM1 (0.67) DNM1HTTSLC22A1ALDH1A1TP53
SCHEMBL333129 1.00 DNM1 (0.67) DNM1HTTSLC22A1ALDH1A1TP53

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
EP-2166611-A1 NONAQUEOUS ELECTROLYTE, AND RECHARGEABLE BATTERY WITH THE NONAQUEOUS ELECTROLYTE Mitsubishi Chemical Corporation (JP) 2010-03-24 EP disclosed