SCHEMBL1729255

SCHEMBL1729255

NC(=O)CN(CC1CCN(c2cccc(-c3ccc(F)cc3)n2)CC1)C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 1/20 0.43
DRD2 P14416 1/20 0.43
DRD4 P21917 1/20 0.43
HTR2A P28223 1/20 0.43
HTR2C P28335 1/20 0.43
HTR7 P34969 1/20 0.43
DRD3 P35462 1/20 0.43
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
CNR1 P21554 1/20 0.41
CKS1B P61024 1/20 0.41
SKP1 P63208 1/20 0.41
SKP2 Q13309 1/20 0.41
SCN9A Q15858 5/20 0.39
AOC3 Q16853 1/20 0.39
FFAR4 Q5NUL3 7/20 0.39
CYP2C9 P11712 2/20 0.39
CYP1A2 P05177 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
SCHEMBL1727912 0.92 CNR1 (0.42) HTR1ADRD2DRD4HTR2AHTR2C
SCHEMBL1728786 0.90 HTR1A (0.42) HTR1ADRD2DRD4HTR2AHTR2C
SCHEMBL1729052 0.84 NPC1 (0.43) HTR1ADRD2DRD4HTR2AHTR2C
SCHEMBL1727572 0.82 CNR1 (0.41) HTR1ADRD2DRD4HTR2AHTR2C
SCHEMBL1727662 0.82 HTR1A (0.43) HTR1ADRD4HTR2ADRD3CKS1B
SCHEMBL1728900 0.81 PRKCQ (0.38) HTR1ADRD2HTR2ADRD3CKS1B
SCHEMBL1730244 0.78 FFAR4 (0.40) HTR1ADRD2HTR7CKS1BSKP1
SCHEMBL1727769 0.78 CHRNA7 (0.43) NPC1RAB9ASMN1; SMN2
SCHEMBL1727675 0.77 CKS1B (0.53) HTR1ADRD2DRD4HTR2AHTR2C
SCHEMBL1728046 0.76 NPC1 (0.49) NPC1RAB9ASMN1; SMN2CKS1BSKP1

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