SCHEMBL8432504

SCHEMBL8432504

Cc1ccc(C2CCN(Cc3ccc4ccc(=O)oc4c3)CC2)cc1

nearest known ligand 0.79

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 17/20 0.79
DRD2 P14416 11/20 0.79
DRD3 P35462 1/20 0.55
CYP19A1 P11511 1/20 0.48
KCNH2 Q12809 1/20 0.48
MCHR2 Q969V1 1/20 0.48
MCHR1 Q99705 1/20 0.48
MAOB P27338 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
SCHEMBL8431212 0.88 DRD4 (1.00) DRD4DRD2MAOB
SCHEMBL8431572 0.81 DRD4 (1.00) DRD4DRD2DRD3
SCHEMBL17432875 0.78 MEN1 (0.61) DRD4DRD2DRD3KCNH2
SCHEMBL4783447 0.76 DRD4 (0.64) DRD4DRD2CYP19A1KCNH2MCHR2
SCHEMBL8435196 0.75 DRD4 (1.00) DRD4DRD2CYP19A1MAOB
SCHEMBL5753083 0.75 DRD2 (0.53) DRD4DRD2DRD3KCNH2MCHR2
SCHEMBL8431470 0.74 DRD4 (1.00) DRD4DRD2
SCHEMBL8431350 0.73 DRD4 (1.00) DRD4DRD2DRD3
SCHEMBL8431263 0.72 DRD4 (1.00) DRD4DRD2
SCHEMBL29869413 0.72 MEN1 (0.54) DRD4DRD2DRD3MCHR1

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-5922719-A 4-AROMATIC-SUBSTITUTED-PIPERAZIN-1-YLMETHYLCHROMEN-2-ONES WARNER-LAMBERT COMPANY (US) 1999-07-13 US disclosed