SCHEMBL6366393

SCHEMBL6366393

CCN(CC)CCCCCCCCCCCN(CC)CC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 2/20 0.46
ALDH1A1 P00352 2/20 0.43
HRH4 Q9H3N8 2/20 0.43
HRH3 Q9Y5N1 2/20 0.43
KCNH2 Q12809 5/20 0.41
PAOX Q6QHF9 1/20 0.41
TSHR P16473 1/20 0.41
DNM1 Q05193 1/20 0.40
SLC2A1 P11166 1/20 0.39
PLA2G1B P04054 1/20 0.39
PLA2G2A P14555 1/20 0.39
CHRM2 P08172 1/20 0.39
HTR1A P08908 1/20 0.39
ADRA2A P08913 1/20 0.39
CHRM1 P11229 1/20 0.39
DRD1 P21728 1/20 0.39
SLC6A2 P23975 1/20 0.39
SLC6A4 P31645 1/20 0.39
ADRA1A P35348 1/20 0.39
OPRM1 P35372 1/20 0.39

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
SCHEMBL28723073 1.00 SIGMAR1 (0.46) SIGMAR1ALDH1A1HRH4HRH3KCNH2
SCHEMBL1313942 1.00 SIGMAR1 (0.46) SIGMAR1ALDH1A1HRH4HRH3KCNH2
SCHEMBL2142541 1.00 SIGMAR1 (0.46) SIGMAR1ALDH1A1HRH4HRH3KCNH2
SCHEMBL2141035 1.00 SIGMAR1 (0.46) SIGMAR1ALDH1A1HRH4HRH3KCNH2
SCHEMBL2137948 1.00 SIGMAR1 (0.46) SIGMAR1ALDH1A1HRH4HRH3KCNH2
SCHEMBL2564528 1.00 SIGMAR1 (0.46) SIGMAR1ALDH1A1HRH4HRH3KCNH2
SCHEMBL757439 0.96 SIGMAR1 (0.44) SIGMAR1ALDH1A1HRH4HRH3KCNH2
SCHEMBL5990364 0.96 SIGMAR1 (0.44) SIGMAR1ALDH1A1HRH4HRH3KCNH2
SCHEMBL15052279 0.96 SIGMAR1 (0.48) SIGMAR1ALDH1A1HRH4HRH3KCNH2
SCHEMBL234338 0.96 SIGMAR1 (0.48) SIGMAR1ALDH1A1HRH4HRH3KCNH2

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-20050131192-A1 Polymer and process for producing polymer SANYO CHEMICAL INDUSTRIES, LTD. (JP) 2005-06-16 US disclosed