SCHEMBL1730154

SCHEMBL1730154

CNC(=O)CN(CCC1CCN(c2ccnc3ccccc23)CC1)C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 6/20 0.42
DRD3 P35462 6/20 0.42
HTR2A P28223 3/20 0.41
HTR1A P08908 2/20 0.41
DRD4 P21917 2/20 0.41
HTR2C P28335 2/20 0.41
HTR2B P41595 2/20 0.41
DRD1 P21728 1/20 0.41
PDGFRB P09619 1/20 0.41
ADRB2 P07550 1/20 0.41
NCF1 P14598 1/20 0.41
AKT1 P31749 1/20 0.40
KCNH2 Q12809 1/20 0.39
FAP Q12884 1/20 0.39
IDO1 P14902 1/20 0.39
F10 P00742 2/20 0.39
ACACB O00763 1/20 0.39
ACACA Q13085 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
SCHEMBL1729120 0.87 F10 (0.44) DRD2DRD3HTR2AHTR1ADRD4
SCHEMBL1727927 0.84 HRH4 (0.44) DRD2DRD3DRD4HTR2CACACB
SCHEMBL1727922 0.81 DRD2 (0.46) DRD2DRD3HTR2AHTR1AADRB2
SCHEMBL1729971 0.81 CYP11B2 (0.42) DRD2HTR2AHTR1AACACBACACA
SCHEMBL1728883 0.80 MAP4K4 (0.44) KCNH2ACACBACACA
SCHEMBL1730192 0.80 CKS1B (0.46) ACACBACACA
SCHEMBL1728164 0.80 KDM4E (0.45) KCNH2ACACBACACA
SCHEMBL1730124 0.79 CHRM4 (0.46) DRD2DRD3HTR2AHTR2C
SCHEMBL1727745 0.79 RXRA (0.46)
SCHEMBL3265695 0.77 SIRT2 (0.45) DRD2DRD3HTR2AHTR1ADRD4

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