SCHEMBL8089965

SCHEMBL8089965

CC(c1ccccn1)c1ccccc1C1=NCCN1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NISCH Q9Y2I1 10/20 0.51
CHRM2 P08172 5/20 0.42
CHRM4 P08173 5/20 0.42
CHRM5 P08912 5/20 0.42
CHRM1 P11229 5/20 0.42
CHRM3 P20309 5/20 0.42
HRH1 P35367 4/20 0.42
ADRA2A P08913 2/20 0.41
ADRA2B P18089 1/20 0.41
ADRA2C P18825 1/20 0.41
CYP2D6 P10635 2/20 0.41
KCNH2 Q12809 2/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2C9 P11712 1/20 0.41
TSHR P16473 1/20 0.41
CYP2C19 P33261 1/20 0.41
HTR1A P08908 1/20 0.41
DRD1 P21728 1/20 0.41
PTGS1 P23219 1/20 0.41
SLC6A2 P23975 1/20 0.41

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
SCHEMBL9579892 0.73 NISCH (0.81) NISCH
SCHEMBL4065129 0.72 NISCH (0.52) NISCHADRA2AADRA2BADRA2CCYP2D6
SCHEMBL28752820 0.72 SLC6A2 (0.42) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL8887144 0.71 NISCH (0.66) NISCHCYP1A2ADRA1A
SCHEMBL725091 0.69 SLC6A2 (0.54) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL4066263 0.69 NISCH (0.62) NISCHCYP1A2
SCHEMBL1626317 0.69 NISCH (1.00) NISCHADRA2AADRA2BADRA2C
SCHEMBL8089961 0.68 NISCH (0.50) NISCH
SCHEMBL28903852 0.67 TAAR1 (0.57) NISCHADRA2AADRA2BADRA2C
SCHEMBL20621456 0.67 GABRA1 (0.55) CHRM2CHRM4CHRM5CHRM1CHRM3

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-6162455-A Method for increasing lean meat, improving the lean meat to fat ratio and improving amino acid utilization in warm-blooded animals AMERICAN CYANAMID COMPANY (US) 2000-12-19 US disclosed