SCHEMBL6450184

SCHEMBL6450184

CC1CNCCN1C1=Nc2ccccc2Nc2sccc21

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 10/20 0.47
DRD2 P14416 8/20 0.47
HTR2C P28335 6/20 0.47
CHRM2 P08172 5/20 0.47
CHRM4 P08173 5/20 0.47
CHRM5 P08912 5/20 0.47
CHRM3 P20309 5/20 0.47
DRD1 P21728 5/20 0.47
HTR2A P28223 5/20 0.47
HTR2B P41595 5/20 0.47
ADRA1D P25100 4/20 0.47
ADRA1A P35348 4/20 0.47
HRH1 P35367 4/20 0.47
ADRA1B P35368 4/20 0.47
KCNH2 Q12809 4/20 0.47
ADRA2A P08913 3/20 0.47
ADRA2B P18089 3/20 0.47
ADRA2C P18825 3/20 0.47
DRD4 P21917 3/20 0.43
DRD3 P35462 2/20 0.43

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
SCHEMBL29545857 0.96 CHRM1 (0.46) CHRM1DRD2HTR2CCHRM2CHRM4
Hydrochloric Acid SCHEMBL5785290 0.82 DRD2 (0.70) CHRM1DRD2HTR2CCHRM2CHRM4
SCHEMBL5321142 0.76 DRD2 (0.70) CHRM1DRD2HTR2CCHRM2CHRM4
SCHEMBL14528087 0.72 CHRM1 (0.47) CHRM1DRD2HTR2CCHRM2CHRM4
SCHEMBL4840573 0.71 CHRM1 (0.48) CHRM1DRD2HTR2CCHRM2CHRM4
SCHEMBL4840562 0.71 CHRM1 (0.48) CHRM1DRD2HTR2CCHRM2CHRM4
SCHEMBL4846102 0.70 CHRM1 (0.44) CHRM1DRD2HTR2CCHRM2CHRM4
SCHEMBL4846096 0.70 CHRM1 (0.44) CHRM1DRD2HTR2CCHRM2CHRM4
SCHEMBL4836530 0.70 CHRM1 (0.46) CHRM1DRD2HTR2CCHRM2CHRM4
SCHEMBL4836611 0.70 CHRM1 (0.46) CHRM1DRD2HTR2CCHRM2CHRM4

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 disclosed
WO-2004000847-A1 A PROCESS FOR THE PREPARATION OF OLANZAPINE AND AN INTERMEDIATE THEREFOR ADAMED SP. Z O.O. (PL) 2003-12-31 WO disclosed