SCHEMBL8433608

SCHEMBL8433608

O=c1ccc2ccc(CN3CCN(c4ccc5ccccc5c4)CC3)cc2o1

nearest known ligand 0.80

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 17/20 0.80
DRD2 P14416 12/20 0.80
DRD3 P35462 1/20 0.53
KMT2A Q03164 1/20 0.50

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
SCHEMBL8431223 0.89 DRD4 (1.00) DRD4DRD2DRD3
SCHEMBL8431572 0.84 DRD4 (1.00) DRD4DRD2DRD3
SCHEMBL8431470 0.84 DRD4 (1.00) DRD4DRD2
SCHEMBL8520441 0.84 DRD4 (0.77) DRD4DRD2DRD3
SCHEMBL8435196 0.83 DRD4 (1.00) DRD4DRD2KMT2A
SCHEMBL8934559 0.81 DRD4 (1.00) DRD4DRD2DRD3
SCHEMBL8435285 0.80 DRD4 (0.76) DRD4DRD2
SCHEMBL8431263 0.80 DRD4 (1.00) DRD4DRD2
SCHEMBL6232404 0.78 KMT2A (0.71) DRD4DRD2DRD3KMT2A
SCHEMBL6230339 0.77 DRD4 (0.68) DRD4DRD2DRD3KMT2A

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