SCHEMBL13967985

SCHEMBL13967985

CN(C)P(=Nc1cccc2oc3ccccc3c12)(N(C)C)N(C)C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 5/20 0.39
CDC14B O60729 1/20 0.38
CDC14A Q9UNH5 1/20 0.38
MAPT P10636 4/20 0.36
KDM4E B2RXH2 4/20 0.36
HPGD P15428 4/20 0.36
ALDH1A1 P00352 4/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
HSD17B10 Q99714 2/20 0.36
GLA P06280 2/20 0.36
CYP3A4 P08684 1/20 0.36
PGAM1 P18669 1/20 0.36
CASP1 P29466 1/20 0.36
CASP7 P55210 1/20 0.36
GAA P10253 3/20 0.36
MGAM O43451 1/20 0.36
SI P14410 1/20 0.36
MGAM2 Q2M2H8 1/20 0.36
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 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
SCHEMBL13967988 0.88 MAOA (0.30) MAOA
SCHEMBL13967976 0.77 HSD17B10 (0.41) MAOAMAPTKDM4EHPGDALDH1A1
SCHEMBL13967984 0.74 MAOA (0.39) MAOACDC14BCDC14AMAPTKDM4E
SCHEMBL13967873 0.74 ALDH1A1 (0.32) ALDH1A1HSD17B10CYP3A4MEN1KMT2A
SCHEMBL13967909 0.74 SIGMAR1 (0.45) MAOAHPGDALDH1A1HSD17B10CYP3A4
SCHEMBL13967977 0.73 ALDH1A1 (0.40) MAPTKDM4EHPGDALDH1A1HSD17B10
SCHEMBL13967990 0.73 GPR3 (0.39) MAPTKDM4EHPGDALDH1A1SMN1; SMN2
SCHEMBL12449847 0.72 MAOA (0.48) MAOACDC14BCDC14AMAPTKDM4E
SCHEMBL21624973 0.71 CYP3A4 (0.46) MAOACDC14BCDC14AMAPTKDM4E
SCHEMBL13967973 0.70 CYP3A4 (0.32) MAPTKDM4EALDH1A1HSD17B10CYP3A4

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
US-20120295148-A1 ELECTROLYTIC SOLUTION FOR SECONDARY BATTERY, SECONDARY BATTERY, ELECTRONIC APPLIANCE, POWER TOOL, ELECTRIC VEHICLE, AND ELECTRIC POWER STORAGE SYSTEM SONY CORPORATION (JP) 2012-11-22 US disclosed
US-20120295148-A1 ELECTROLYTIC SOLUTION FOR SECONDARY BATTERY, SECONDARY BATTERY, ELECTRONIC APPLIANCE, POWER TOOL, ELECTRIC VEHICLE, AND ELECTRIC POWER STORAGE SYSTEM SONY CORPORATION (JP) 2012-11-22 US disclosed