SCHEMBL28285386

SCHEMBL28285386

CN(C)CCc1nccn1C

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FDPS P14324 1/20 0.41
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
TSHR P16473 1/20 0.39
LPO P22079 1/20 0.39
DRD4 P21917 1/20 0.38
LMNA P02545 2/20 0.37
CHRNB2 P17787 1/20 0.37
CHRNA4 P43681 1/20 0.37
CXCR4 P61073 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
HRH1 P35367 1/20 0.36
HTT P42858 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
CHRNA7 P36544 1/20 0.35
CNR2 P34972 1/20 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
SCHEMBL8264017 0.83 TSHR (0.44) FDPSMEN1KMT2ATSHRLPO
SCHEMBL7154948 0.83 FDPS (0.48) FDPSMEN1KMT2ATSHRLPO
SCHEMBL27220830 0.81 DRD4 (0.49) FDPSMEN1KMT2ATSHRLPO
Bromide SCHEMBL29657458 0.81 FDPS (0.47) FDPSMEN1KMT2ATSHRLPO
SCHEMBL9043588 0.79
SCHEMBL16213758 0.79 LMNA (0.51) FDPSMEN1KMT2ATSHRLPO
SCHEMBL2398203 0.79 FDPS (0.46) FDPSMEN1KMT2ATSHRLPO
SCHEMBL7166348 0.79 FDPS (0.46) FDPSMEN1KMT2ATSHRLPO
SCHEMBL11886141 0.78 CHRNA7 (0.34) CYP2D6CHRNA7
SCHEMBL12087626 0.78 TSHR (0.43) FDPSMEN1KMT2ATSHRLPO

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
CN-109563050-A Amide salt compound, for the catalyst of polyurethane production and the production method of polyurethane resin 广荣化学工业株式会社 2019-04-02 CN disclosed