SCHEMBL6465487

SCHEMBL6465487

CN1c2ccccc2N=C(N2CCNCC2)c2ccsc21

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 9/20 0.50
CHRM2 P08172 4/20 0.46
CHRM4 P08173 4/20 0.46
CHRM5 P08912 4/20 0.46
CHRM1 P11229 4/20 0.46
CHRM3 P20309 4/20 0.46
DRD1 P21728 4/20 0.46
KCNH2 Q12809 4/20 0.46
ADRA2A P08913 3/20 0.46
ADRA2B P18089 3/20 0.46
ADRA2C P18825 3/20 0.46
ADRA1D P25100 3/20 0.46
HTR2A P28223 3/20 0.46
HTR2C P28335 3/20 0.46
ADRA1A P35348 3/20 0.46
HRH1 P35367 3/20 0.46
HTR2B P41595 3/20 0.46
ADRA1B P35368 2/20 0.46
DRD4 P21917 4/20 0.42
HRH4 Q9H3N8 3/20 0.42

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
SCHEMBL6354527 0.89 DRD2 (0.53) DRD2CHRM2CHRM4CHRM5CHRM1
SCHEMBL6444622 0.83 DRD2 (0.43) DRD2CHRM2CHRM4CHRM5CHRM1
SCHEMBL4431761 0.82 DRD2 (0.57) DRD2CHRM2CHRM4CHRM5CHRM1
SCHEMBL11634221 0.79 DRD2 (0.54) DRD2CHRM2CHRM4CHRM5CHRM1
SCHEMBL11631895 0.72 DRD2 (0.49) DRD2CHRM2CHRM4CHRM5CHRM1
Fumaric Acid SCHEMBL11633253 0.71 HRH4 (0.51) DRD2CHRM2CHRM4CHRM5CHRM1
Fumaric Acid SCHEMBL11633258 0.71 HRH4 (0.51) DRD2CHRM2CHRM4CHRM5CHRM1
SCHEMBL4419372 0.71 DRD2 (0.57) DRD2CHRM2CHRM4CHRM5CHRM1
SCHEMBL4431750 0.71 DRD2 (0.57) DRD2CHRM2CHRM4CHRM5CHRM1
SCHEMBL11055681 0.71 DRD2 (0.47) DRD2CHRM2CHRM4CHRM5CHRM1

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
EP-1513845-A1 A PROCESS FOR THE PREPARATION OF OLANZAPINE AND AN INTERMEDIATE THEREFOR Adamed SP. Z O.O. (PL) 2005-03-16 EP claimed
WO-2004000847-A1 A PROCESS FOR THE PREPARATION OF OLANZAPINE AND AN INTERMEDIATE THEREFOR ADAMED SP. Z O.O. (PL) 2003-12-31 WO claimed