Nicametate

Nicametate

SCHEMBL5060940

CCN(CC)CCOC(=O)c1cccnc1.CCN(CC)CCOC(=O)c1cccnc1

nearest known ligand 0.68

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.68
LMNA P02545 6/20 0.64
TSHR P16473 3/20 0.59
CYP2D6 P10635 1/20 0.57
MAOA P21397 1/20 0.57
HTR3A P46098 1/20 0.57
HRH3 Q9Y5N1 1/20 0.57
KMT2A Q03164 4/20 0.56
MEN1 O00255 2/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
BLM P54132 1/20 0.56
NPSR1 Q6W5P4 1/20 0.56
SCN1A P35498 1/20 0.55
SCN2A Q99250 1/20 0.55
SCN3A Q9NY46 1/20 0.55
ALDH1A1 P00352 3/20 0.54
MAPT P10636 2/20 0.54
HPGD P15428 1/20 0.54
TDP1 Q9NUW8 1/20 0.54
CYP1A2 P05177 1/20 0.51

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
Nicametate SCHEMBL34040 1.00 L3MBTL1 (0.68) L3MBTL1LMNATSHRCYP2D6MAOA
Nicametate SCHEMBL28346401 0.96 L3MBTL1 (0.63) L3MBTL1LMNATSHRCYP2D6MAOA
Nicametate SCHEMBL194781 0.87 KDM4E (0.56) L3MBTL1LMNATSHRCYP2D6MAOA
SCHEMBL3079077 0.86 MAPT (0.62) LMNATSHRCYP2D6MAOAHTR3A
Procaine SCHEMBL9312338 0.86 CYP2D6 (0.69) L3MBTL1LMNATSHRCYP2D6MAOA
SCHEMBL9717097 0.85 L3MBTL1 (0.67) L3MBTL1LMNAKMT2AMEN1ALDH1A1
Procaine SCHEMBL9312532 0.85 BLM (0.70) L3MBTL1LMNATSHRCYP2D6MAOA
SCHEMBL382067 0.83 L3MBTL1 (0.82) L3MBTL1LMNATSHRKMT2AMEN1
SCHEMBL25009812 0.83 L3MBTL1 (0.76) L3MBTL1LMNACYP2D6KMT2AMEN1
SCHEMBL30556174 0.83 L3MBTL1 (0.76) L3MBTL1LMNACYP2D6KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1931760-A2 MULTI-FUNCTIONAL IONIC LIQUID COMPOSITIONS The University of Alabama (US) 2008-06-18 EP disclosed
WO-2007044693-A2 MULTI-FUNCTIONAL IONIC LIQUID COMPOSITIONS THE UNIVERSITY OF ALABAMA (US) 2007-04-19 WO disclosed