SCHEMBL6635360

SCHEMBL6635360

[c]1cccc(OCCNCc2ccccc2)c1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 8/20 0.71
DRD2 P14416 5/20 0.57
DRD3 P35462 5/20 0.57
ADRA1D P25100 2/20 0.57
ADRA1A P35348 2/20 0.57
ADRA1B P35368 2/20 0.57
PPARG P37231 1/20 0.56
GAA P10253 1/20 0.51
KMT2A Q03164 2/20 0.48
MEN1 O00255 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
HTR1A P08908 1/20 0.47
HDAC3 O15379 1/20 0.46
HDAC4 P56524 1/20 0.46
HDAC1 Q13547 1/20 0.46
HDAC7 Q8WUI4 1/20 0.46
HDAC2 Q92769 1/20 0.46
HDAC10 Q969S8 1/20 0.46
HDAC11 Q96DB2 1/20 0.46
HDAC8 Q9BY41 1/20 0.46

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
SCHEMBL6633520 0.87 DRD4 (0.53) DRD4DRD2DRD3ADRA1DADRA1A
SCHEMBL6635774 0.86 SCN8A (0.53) DRD4DRD2DRD3ADRA1DADRA1A
SCHEMBL6637332 0.84 KDM4E (0.49) DRD4DRD2DRD3ADRA1DADRA1A
SCHEMBL6636607 0.84 SCN8A (0.58) DRD4DRD2DRD3ADRA1DADRA1A
SCHEMBL8740486 0.84 DRD4 (1.00) DRD4DRD2DRD3ADRA1DADRA1A
SCHEMBL6639679 0.81 CHRM2 (0.46) DRD4DRD2DRD3ADRA1DADRA1A
SCHEMBL6634888 0.80 DRD4 (0.48) DRD4DRD2DRD3ADRA1DADRA1A
SCHEMBL921154 0.79 NPC1 (0.51) DRD4DRD2DRD3GAA
SCHEMBL7019049 0.78 DRD4 (0.47) DRD4DRD2DRD3ADRA1DADRA1A
SCHEMBL6635548 0.78 SCN8A (0.53) KMT2AMEN1TDP1SCN8A

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-1165557-B1 ARYL AND HETEROARYL FUSED AMINOALKYL-IMIDAZOLE DERIVATIVES: SELECTIVE MODULATORS OF GABAa RECEPTORS NEUROGEN CORP (US) 2004-09-29 EP claimed
EP-1165557-B1 ARYL AND HETEROARYL FUSED AMINOALKYL-IMIDAZOLE DERIVATIVES: SELECTIVE MODULATORS OF GABAa RECEPTORS NEUROGEN CORP (US) 2004-09-29 EP disclosed