SCHEMBL6421371

SCHEMBL6421371

c1ccc(-c2cn3ccccc3n2)c(-c2ccc(OCCCN3CCCCC3)cc2)c1

nearest known ligand 0.84

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 15/20 0.84
HTR1A P08908 2/20 0.61
HTR7 P34969 2/20 0.61
DRD2 P14416 3/20 0.59
DRD3 P35462 3/20 0.59

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
SCHEMBL5261357 0.91 HRH3 (1.00) HRH3HTR1AHTR7DRD2DRD3
SCHEMBL6421374 0.90 HRH3 (0.98) HRH3HTR1AHTR7DRD2DRD3
SCHEMBL6421382 0.89 HRH3 (0.73) HRH3HTR1AHTR7DRD2DRD3
SCHEMBL6421366 0.85 HRH3 (0.77) HRH3HTR1AHTR7DRD2DRD3
SCHEMBL6633641 0.80 HRH3 (1.00) HRH3
SCHEMBL5416238 0.78 HRH3 (1.00) HRH3DRD2DRD3
SCHEMBL6636102 0.78 HRH3 (1.00) HRH3
SCHEMBL6291771 0.76 HRH3 (1.00) HRH3DRD2DRD3
SCHEMBL6635334 0.76 HRH3 (1.00) HRH3
SCHEMBL4653816 0.76 HRH3 (1.00) HRH3DRD2DRD3

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
US-6908929-B2 Phenyl-substituted imidazopyridines ORTHO-MCNEIL PHARMACEUTICAL, INC. (US) 2005-06-21 US claimed