SCHEMBL5656008

SCHEMBL5656008

CCOc1ccccc1N(CCN1CCN(c2cccc(NS(C)(=O)=O)c2)CC1)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 5/20 0.54
DRD2 P14416 1/20 0.48
ADRA1A P35348 1/20 0.48
DRD3 P35462 1/20 0.48
HTR1A P08908 5/20 0.45
MAPT P10636 3/20 0.42
TP53 P04637 1/20 0.41
OPRM1 P35372 1/20 0.41
ADRB2 P07550 2/20 0.40
ADRB1 P08588 2/20 0.40
ADRB3 P13945 2/20 0.40
LMNA P02545 1/20 0.40
TSHR P16473 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
KMT2A Q03164 1/20 0.40
KCNH2 Q12809 1/20 0.40
PTK2 Q05397 1/20 0.40
MET P08581 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
SCHEMBL5654667 0.88 HTR7 (0.53) HTR7HTR1AMAPTTP53KCNH2
SCHEMBL5655916 0.85 MAPT (0.50) DRD2ADRA1ADRD3HTR1AMAPT
SCHEMBL5657837 0.85 HTR1A (0.56) HTR7DRD2ADRA1AHTR1AMAPT
SCHEMBL6415441 0.85 MAPT (0.52) HTR7DRD2DRD3HTR1AMAPT
SCHEMBL5657971 0.85 KCNH2 (0.50) HTR7DRD2DRD3HTR1AMAPT
SCHEMBL5657779 0.85 HTR1A (0.59) HTR7HTR1AMAPTLMNATSHR
SCHEMBL5656134 0.85 HTR1A (0.48) HTR7ADRA1AHTR1AMAPTOPRM1
SCHEMBL6753307 0.84 HTR7 (0.43) HTR7DRD2ADRA1AHTR1AOPRM1
SCHEMBL5656201 0.84 HTR1A (0.55) HTR7DRD2ADRA1ADRD3HTR1A
SCHEMBL6416890 0.82 DRD2 (0.52) DRD2ADRA1ADRD3MAPTTP53

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-7238693-B2 Aryl carbamate derivatives, preparation and use thereof CEREP (FR) 2007-07-03 US disclosed