SCHEMBL6981463

SCHEMBL6981463

COc1c(C(=O)NCCN2CCN(c3cccc(Cl)c3)CC2)cc(Br)c2ccccc12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 19/20 1.00
DRD2 P14416 14/20 1.00
DRD4 P21917 2/20 0.75
SIGMAR1 Q99720 1/20 0.70

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
SCHEMBL6985375 0.92 DRD3 (1.00) DRD3DRD2DRD4
SCHEMBL6986108 0.92 DRD3 (1.00) DRD3DRD2
SCHEMBL6985952 0.87 DRD3 (1.00) DRD3DRD2DRD4SIGMAR1
SCHEMBL6978822 0.86 DRD3 (1.00) DRD3DRD2DRD4SIGMAR1
SCHEMBL6982595 0.85 DRD3 (1.00) DRD3DRD2DRD4SIGMAR1
SCHEMBL8528789 0.84 DRD3 (0.79) DRD3DRD2DRD4SIGMAR1
SCHEMBL6984294 0.83 DRD3 (1.00) DRD3DRD2DRD4
SCHEMBL6984226 0.83 DRD3 (1.00) DRD3DRD2DRD4
SCHEMBL6985049 0.83 DRD3 (1.00) DRD3DRD2DRD4SIGMAR1
SCHEMBL8286906 0.82 DRD2 (1.00) DRD3DRD2DRD4SIGMAR1

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0751939-B9 NAPHTHYLAMIDES AS CENTRAL NERVOUS SYSTEM AGENTS WARNER LAMBERT CO (US) 2003-01-02 EP claimed
EP-0751939-B1 NAPHTHYLAMIDES AS CENTRAL NERVOUS SYSTEM AGENTS WARNER LAMBERT CO (US) 2002-06-12 EP claimed
WO-1995025727-A1 NAPHTHYLAMIDES AS CENTRAL NERVOUS SYSTEM AGENTS WARNER-LAMBERT COMPANY (US) 1995-09-28 WO claimed
US-5395835-A Antipsychotic agents WARNER-LAMBERT COMPANY (US) 1995-03-07 US claimed
EP-0751939-B9 NAPHTHYLAMIDES AS CENTRAL NERVOUS SYSTEM AGENTS WARNER LAMBERT CO (US) 2003-01-02 EP disclosed
EP-0751939-B1 NAPHTHYLAMIDES AS CENTRAL NERVOUS SYSTEM AGENTS WARNER LAMBERT CO (US) 2002-06-12 EP disclosed
EP-0751939-A1 NAPHTHYLAMIDES AS CENTRAL NERVOUS SYSTEM AGENTS WARNER-LAMBERT COMPANY (US) 1997-01-08 EP disclosed
WO-1995025727-A1 NAPHTHYLAMIDES AS CENTRAL NERVOUS SYSTEM AGENTS WARNER-LAMBERT COMPANY (US) 1995-09-28 WO disclosed
US-5395835-A Antipsychotic agents WARNER-LAMBERT COMPANY (US) 1995-03-07 US disclosed