SCHEMBL7444282

SCHEMBL7444282

CCCNCCOc1cc[c]cc1

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 15/20 0.50
DRD2 P14416 14/20 0.50
DRD3 P35462 12/20 0.50
HTR1B P28222 1/20 0.45
GAA P10253 1/20 0.43
TSHR P16473 1/20 0.43
KDM4E B2RXH2 1/20 0.42
RECQL P46063 1/20 0.42

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
SCHEMBL1282727 0.87 DRD4 (0.47) DRD4DRD2DRD3HTR1BGAA
SCHEMBL5316000 0.82 KMT2A (0.53) DRD4DRD2DRD3HTR1BTSHR
SCHEMBL2181408 0.82 DRD2 (0.44) DRD4DRD2DRD3
SCHEMBL2182360 0.81 SMN1; SMN2 (0.53) DRD4DRD2DRD3HTR1BGAA
SCHEMBL7917299 0.81 DRD4 (0.74) DRD4DRD2DRD3HTR1BGAA
SCHEMBL2184548 0.81 DRD2 (0.46) DRD4DRD2DRD3GAAKDM4E
SCHEMBL127508 0.80 LTA4H (0.50) KDM4E
SCHEMBL7019049 0.80 DRD4 (0.47) DRD4DRD2DRD3HTR1BGAA
SCHEMBL14294277 0.79 DRD2 (0.79) DRD4DRD2DRD3KDM4E
SCHEMBL4227450 0.79 HTR1B (0.64) DRD4DRD2DRD3HTR1BKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2002541151-A 2002-12-03 JP claimed
EP-1165557-A1 ARYL AND HETEROARYL FUSED AMINOALKYL-IMIDAZOLE DERIVATIVES: SELECTIVE MODULATORS OF GABAa RECEPTORS NEUROGEN CORPORATION (US) 2002-01-02 EP claimed
WO-2000059905-A1 ARYL AND HETEROARYL FUSED AMINOALKYL-IMIDAZOLE DERIVATIVES: SELECTIVE MODULATORS OF GABAa RECEPTORS NEUROGEN CORPORATION (US) 2000-10-12 WO claimed
EP-1165557-A1 ARYL AND HETEROARYL FUSED AMINOALKYL-IMIDAZOLE DERIVATIVES: SELECTIVE MODULATORS OF GABAa RECEPTORS NEUROGEN CORPORATION (US) 2002-01-02 EP disclosed
WO-2000059905-A1 ARYL AND HETEROARYL FUSED AMINOALKYL-IMIDAZOLE DERIVATIVES: SELECTIVE MODULATORS OF GABAa RECEPTORS NEUROGEN CORPORATION (US) 2000-10-12 WO disclosed