SCHEMBL9762225

SCHEMBL9762225

O=C1CCON1Cc1cscn1

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PDE1A P54750 1/20 0.37
PDE1B Q01064 1/20 0.37
PDE1C Q14123 1/20 0.37
CHRM2 P08172 2/20 0.36
CHRM4 P08173 2/20 0.36
CHRM5 P08912 2/20 0.36
CHRM1 P11229 2/20 0.36
CHRM3 P20309 2/20 0.36
KCNH2 Q12809 3/20 0.34
DRD2 P14416 1/20 0.34
ALDH1A1 P00352 1/20 0.34
HPGD P15428 1/20 0.34
HTT P42858 1/20 0.34
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
OPRD1 P41143 3/20 0.31
OPRM1 P35372 2/20 0.31
SLC6A3 Q01959 1/20 0.31
SCN9A Q15858 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
SCHEMBL9760995 0.73 CHRM2 (0.36) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL9762377 0.73 BRD4 (0.38) PDE1APDE1BPDE1CKCNH2DRD2
SCHEMBL9762101 0.72 CYP2C9 (0.41) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL9762460 0.71 RIPK3 (0.37) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL9762539 0.70 CHRM2 (0.36) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL15974385 0.70 ALDH1A1 (0.40) PDE1APDE1BPDE1CKCNH2DRD2
SCHEMBL9762399 0.68 BRD4 (0.35) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL9762485 0.66 CHRM2 (0.38) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL9762141 0.66 KDM4E (0.39) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL7847449 0.65 L3MBTL1 (0.45) 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-5066665-A Cognition activators; alzheimer*s disease WARNER-LAMBERT CO. (US) 1991-11-19 US disclosed