SCHEMBL9703793

SCHEMBL9703793

C1=C(c2ccccc2)CCN(CCC2CCC(c3c[nH]c4ccccc34)CC2)C1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 2/20 0.56
DRD3 P35462 2/20 0.56
DRD4 P21917 1/20 0.56

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
SCHEMBL9703843 0.86 DRD2 (0.52) DRD2DRD3DRD4
SCHEMBL9705545 0.86 DRD2 (0.64) DRD2DRD3DRD4
SCHEMBL4483845 0.76 DRD2 (0.64) DRD2DRD3DRD4
SCHEMBL9773137 0.76 DRD2 (0.64) DRD2DRD3DRD4
SCHEMBL4483728 0.75 DRD2 (0.62) DRD2DRD3DRD4
SCHEMBL7700873 0.74 ADRA1D (0.65) DRD2DRD3DRD4
SCHEMBL9703330 0.74 DRD2 (0.81) DRD2DRD3DRD4
SCHEMBL9874332 0.74 DRD2 (0.61) DRD2DRD3DRD4
SCHEMBL10749274 0.73 DRD2 (0.48) DRD2DRD3DRD4
SCHEMBL10855215 0.73 DRD2 (0.52) DRD2DRD3DRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1992012977-A1 SUBSTITUTED INDOLES AS CENTRAL NERVOUS SYSTEM AGENTS WARNER-LAMBERT COMPANY (US) 1992-08-06 WO claimed
WO-1992012977-A1 SUBSTITUTED INDOLES AS CENTRAL NERVOUS SYSTEM AGENTS WARNER-LAMBERT COMPANY (US) 1992-08-06 WO disclosed
US-5124332-A Dopaminergic agents, hypotensive agents WARNER-LAMBERT COMPANY (US) 1992-06-23 US disclosed