SCHEMBL1730207

SCHEMBL1730207

O=C(O)NC1CCN(c2cccc(-c3ccc(F)cc3)n2)CC1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 2/20 0.50
SCN9A Q15858 2/20 0.48
CYP11B2 P19099 2/20 0.46
HTR1A P08908 1/20 0.45
DRD2 P14416 1/20 0.45
DRD4 P21917 1/20 0.45
HTR2A P28223 1/20 0.45
HTR2C P28335 1/20 0.45
HTR7 P34969 1/20 0.45
DRD3 P35462 1/20 0.45
HSD11B1 P28845 2/20 0.44
PRKAA2 P54646 1/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
SMO Q99835 1/20 0.43
CKS1B P61024 2/20 0.42
SKP1 P63208 2/20 0.42
SKP2 Q13309 2/20 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
SCHEMBL1729064 0.90 CNR1 (0.52) CNR1HSD11B1SMN1; SMN2SMOCKS1B
SCHEMBL1727675 0.83 CKS1B (0.53) CNR1SCN9AHTR1ADRD2DRD4
SCHEMBL3270072 0.82 SCN9A (0.44) CNR1SCN9ACYP11B2HTR1ADRD2
SCHEMBL1710740 0.81 CHRM4 (0.48) CNR1SCN9AHTR1ADRD2DRD4
SCHEMBL16695413 0.80 NOTUM (0.58) CNR1SCN9AHTR1ADRD2DRD4
SCHEMBL27629096 0.79 CKS1B (0.53) CNR1HSD11B1SMN1; SMN2SMOCKS1B
SCHEMBL1729788 0.78 TDO2 (0.53) HTR1ADRD4HTR2ADRD3CKS1B
SCHEMBL1579559 0.77 HSD11B1 (0.49) DRD2DRD3HSD11B1SMN1; SMN2SMO
SCHEMBL3289000 0.77 HTR3E (0.58) HSD11B1L3MBTL1CKS1BSKP1SKP2
SCHEMBL5219893 0.77 DRD2 (0.56) HTR1ADRD2DRD4HTR2AHTR2C

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
EP-1633735-B1 DERIVATIVES OF PIPERIDINYL- AND PIPERAZINYL-ALKYL CARBAMATES, PREPARATION METHODS THEREOF AND APPLICATION OF SAME IN THERAPEUTICS SANOFI SA (FR) 2011-11-30 EP claimed