SCHEMBL9801688

SCHEMBL9801688

CC(N)CC(C)N1CCNCC1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.36
TSHR P16473 1/20 0.36
MAPK1 P28482 1/20 0.36
CHRM2 P08172 1/20 0.33
CHRM1 P11229 1/20 0.33
CHRM5 P08912 1/20 0.32
CHRM3 P20309 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
HRH1 P35367 1/20 0.31
SLC6A2 P23975 4/20 0.31
SLC6A4 P31645 4/20 0.31
CYP2D6 P10635 2/20 0.31
SIGMAR1 Q99720 1/20 0.31
HTR7 P34969 1/20 0.31
SLC6A3 Q01959 1/20 0.31
KCNH2 Q12809 1/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
CYP19A1 P11511 1/20 0.31
USP2 O75604 1/20 0.30

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
SCHEMBL17257571 0.84 CHRM2 (0.34) CHRM2CHRM1CHRM5CHRM3MEN1
SCHEMBL9801209 0.80 SMN1; SMN2 (0.37) CHRM2CHRM1CHRM5CHRM3MEN1
SCHEMBL19958531 0.80 CHRM2 (0.33) CHRM2CHRM1CHRM5CHRM3MEN1
SCHEMBL10305702 0.79 MEN1 (0.33) CHRM2CHRM1CHRM5CHRM3MEN1
SCHEMBL9801682 0.78 DPP7 (0.42) ALDH1A1TSHRMAPK1MEN1KMT2A
SCHEMBL18855182 0.77 CHRM5 (0.36) CHRM2CHRM1CHRM5CHRM3MEN1
SCHEMBL18856216 0.77 SLC6A2 (0.35) CHRM2CHRM1CHRM5CHRM3SLC6A2
SCHEMBL17623313 0.77
SCHEMBL2551138 0.76 KDM4E (0.37) CHRM2CHRM1CHRM5CHRM3MEN1
SCHEMBL13419180 0.76 KDM4E (0.37) CHRM2CHRM1CHRM5CHRM3MEN1

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
WO-2009023544-A2 DOSAGE UNIT ANION-EXCHANGE POLYMER PHARMACEUTICAL COMPOSITIONS ILYPSA, INC. (US) 2009-02-19 WO disclosed
US-4992150-A Telomer with alpha-olefin;oil and fuel additive NIPPON OIL CO, LTD. (JP) 1991-02-12 US disclosed