SCHEMBL16465745

SCHEMBL16465745

CC(C)(C)c1nc(N2CCN(CCCCNC(=O)n3ccc4ccccc43)CC2)cc(C(F)(F)F)n1

nearest known ligand 0.72

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 20/20 0.72
DRD3 P35462 20/20 0.72

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
SCHEMBL17005629 0.86 DRD2 (0.77) DRD2DRD3
SCHEMBL16463974 0.84 DRD2 (1.00) DRD2DRD3
SCHEMBL16462899 0.84 DRD2 (1.00) DRD2DRD3
SCHEMBL16465428 0.83 DRD2 (1.00) DRD2DRD3
SCHEMBL16462668 0.83 DRD2 (1.00) DRD2DRD3
SCHEMBL16463352 0.82 DRD2 (1.00) DRD2DRD3
SCHEMBL16462389 0.82 DRD2 (1.00) DRD2DRD3
SCHEMBL16462631 0.82 DRD2 (1.00) DRD2DRD3
SCHEMBL16462502 0.82 DRD2 (1.00) DRD2DRD3
SCHEMBL16463824 0.81 DRD2 (1.00) DRD2DRD3

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
EP-2906221-A1 UREA AND AMIDE DERIVATIVES OF AMINOALKYLPIPERAZINES AND USE THEREOF Southern Research Institute (US) 2015-08-19 EP disclosed
WO-2014059265-A1 UREA AND AMIDE DERIVATIVES OF AMINOALKYLPIPERAZINES AND USE THEREOF SOUTHERN RESEARCH INSTITUTE (US) 2014-04-17 WO disclosed