SCHEMBL7080575

SCHEMBL7080575

C[N+]1(C(N)=O)C(=O)N(CCCN2CCC(c3ccccn3)CC2)CC1c1ccc(F)c(F)c1

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ADRA1A P35348 10/20 0.48
DRD4 P21917 9/20 0.42
DRD2 P14416 7/20 0.42
DRD3 P35462 4/20 0.42
ADRA1D P25100 7/20 0.41
ADRA1B P35368 7/20 0.41

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
SCHEMBL6962974 0.80 ADRA1A (0.50) ADRA1ADRD4DRD2DRD3ADRA1D
SCHEMBL7080576 0.74 ADRA1A (0.46) ADRA1ADRD4DRD2DRD3ADRA1D
SCHEMBL7212047 0.71 ADRA1A (0.60) ADRA1AADRA1DADRA1B
SCHEMBL7218041 0.70 ADRA1A (0.61) ADRA1AADRA1DADRA1B
SCHEMBL7218158 0.70 ADRA1A (0.47) ADRA1ADRD4DRD2DRD3ADRA1D
SCHEMBL7966207 0.69 ADRA1A (0.63) ADRA1AADRA1DADRA1B
SCHEMBL7966238 0.69 ADRA1A (0.63) ADRA1AADRA1DADRA1B
SCHEMBL7959697 0.69 ADRA1A (0.65) ADRA1ADRD2ADRA1DADRA1B
SCHEMBL7966205 0.69 ADRA1A (0.63) ADRA1AADRA1DADRA1B
SCHEMBL7932393 0.69 ADRA1A (0.76) ADRA1AADRA1DADRA1B

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0988295-A4 HETEROCYCLIC SUBSTITUTED PIPERIDINES AND USES THEREOF SYNAPTIC PHARMA CORP (US) 2003-08-13 EP disclosed
EP-0988295-A1 HETEROCYCLIC SUBSTITUTED PIPERIDINES AND USES THEREOF SYNAPTIC PHARMACEUTICAL CORPORATION (US) 2000-03-29 EP disclosed
WO-1998057940-A1 HETEROCYCLIC SUBSTITUTED PIPERIDINES AND USES THEREOF SYNAPTIC PHARMACEUTICAL CORPORATION (US) 1998-12-23 WO disclosed