SCHEMBL7252843

SCHEMBL7252843

CCCNC[C@H]1CCc2ccc(OCc3ccccc3)cc2O1

nearest known ligand 0.78

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 1/20 0.78
DRD2 P14416 2/20 0.55
DRD4 P21917 2/20 0.55
DRD3 P35462 2/20 0.55
DRD1 P21728 1/20 0.55
DRD5 P21918 1/20 0.55

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
SCHEMBL7113648 0.94 HTR6 (0.81) HTR6DRD2DRD4DRD3DRD1
SCHEMBL7114790 0.91 HTR6 (0.77) HTR6DRD2DRD4DRD3DRD1
SCHEMBL7114786 0.91 HTR6 (0.77) HTR6DRD2DRD4DRD3DRD1
SCHEMBL7256045 0.90 HTR6 (0.63) HTR6DRD2DRD4DRD3DRD1
SCHEMBL7119070 0.89 HTR6 (0.88) HTR6DRD2DRD4DRD3DRD1
SCHEMBL7122467 0.89 HTR6 (0.77) HTR6
SCHEMBL7122465 0.89 HTR6 (0.77) HTR6
SCHEMBL7116714 0.88 HTR6 (0.83) HTR6DRD2DRD4DRD3DRD1
SCHEMBL7118984 0.88 HTR6 (0.76) HTR6DRD2DRD4DRD3DRD1
SCHEMBL7118985 0.88 HTR6 (0.76) HTR6DRD2DRD4DRD3DRD1

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-2003029239-A1 CHROMAN AND BENZOFURAN DERIVATIVES AS 5-HYDROXYTRYPTAMINE-6 LIGANDS WYETH (US) 2003-04-10 WO claimed