SCHEMBL15325005

SCHEMBL15325005

C=CN1CCN(CCO)C1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.39
KDM4E B2RXH2 1/20 0.39
KMT2A Q03164 4/20 0.36
MEN1 O00255 3/20 0.36
CYP3A4 P08684 2/20 0.36
CYP2C19 P33261 2/20 0.36
CYP2C9 P11712 1/20 0.36
LMNA P02545 1/20 0.33
HTT P42858 1/20 0.33
MAPT P10636 1/20 0.33
PKM P14618 1/20 0.32
SLC18A3 Q16572 1/20 0.32
MAPK1 P28482 3/20 0.31
CHRM2 P08172 1/20 0.31
HTR1A P08908 1/20 0.31
ADRA2A P08913 1/20 0.31
CHRM1 P11229 1/20 0.31
DRD2 P14416 1/20 0.31
ADRA2B P18089 1/20 0.31
ADRA2C P18825 1/20 0.31

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
SCHEMBL20143645 0.86
SCHEMBL15689958 0.80 HRH3 (0.37) KCNH2HRH3
SCHEMBL15590867 0.80 HRH3 (0.37) KCNH2HRH3
SCHEMBL15689947 0.80 HRH3 (0.37) KCNH2HRH3
SCHEMBL15590794 0.80 HRH3 (0.37) KCNH2HRH3
SCHEMBL15590761 0.80 HRH3 (0.37) KCNH2HRH3
SCHEMBL10755143 0.75 ALDH1A1 (0.52) ALDH1A1KDM4EKMT2AMEN1CYP3A4
SCHEMBL15590758 0.75 GNAI3 (0.37) KDM4EKMT2AMEN1LMNACHRM2
SCHEMBL10406225 0.74 KDM4E (0.39) ALDH1A1KDM4EKMT2AMEN1CYP3A4
SCHEMBL15743642 0.74

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
US-20130274485-A1 METHOD OF MANUFACTURING CYCLIC CARBONATE BY USING IONIC LIQUID POLYMER I-SHOU UNIVERSITY (TW) 2013-10-17 US disclosed