SCHEMBL7051836

SCHEMBL7051836

N#Cc1cccc(CC2CCN(CCCCN3C(=O)c4ccccc4C3=O)CC2)c1

nearest known ligand 0.55

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 8/20 0.55
HTR2A P28223 1/20 0.54
DRD2 P14416 1/20 0.53
ACHE P22303 1/20 0.48

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
SCHEMBL7971718 0.84 CCR3 (0.66) CCR3DRD2ACHE
SCHEMBL7055295 0.84 DRD2 (0.55) CCR3DRD2ACHE
SCHEMBL6219793 0.81 DRD2 (0.63) CCR3DRD2ACHE
SCHEMBL7056235 0.81 DRD2 (0.55) CCR3DRD2ACHE
SCHEMBL7057303 0.80 DRD2 (0.55) CCR3HTR2ADRD2
SCHEMBL7057916 0.80 HRH1 (0.59) CCR3DRD2
SCHEMBL7053892 0.78 HTR1A (0.69) HTR2ADRD2
SCHEMBL31026378 0.78 HTR1A (0.69) HTR2ADRD2
SCHEMBL21997738 0.75 CASP3 (0.55)
SCHEMBL236787 0.75 TDP1 (0.52)

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
WO-2003028725-A1 4-(1-PIPERIDINY)-BUTYLCARBOXAMIDE AS D3 DOPAMINE RECEPTOR SUBTYPE SELECTIVE LIGANDS Richter Gedeon Vegyészeti Gyár Rt. (HU) 2003-04-10 WO disclosed