SCHEMBL7720307

SCHEMBL7720307

CC(C)(C)[Si](Oc1cccc2c1CCC=C(OS(=O)(=O)C(F)(F)F)C2)(c1ccccc1)c1ccccc1

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 9/20 0.35
DRD3 P35462 6/20 0.35
HTR1D P28221 2/20 0.35
DRD4 P21917 3/20 0.31
HTR5A P47898 1/20 0.31
DRD1 P21728 1/20 0.30
DRD5 P21918 1/20 0.30

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
SCHEMBL7716620 0.78 DRD2 (0.34) DRD2DRD3HTR1DDRD4HTR5A
SCHEMBL7718293 0.76
SCHEMBL7718298 0.76 TRPA1 (0.32)
SCHEMBL7483555 0.75 CYP2A6 (0.38)
SCHEMBL7717820 0.73 RXRA (0.33) DRD2DRD3DRD1DRD5
SCHEMBL8078129 0.71 DRD2 (0.31) DRD2DRD3DRD4DRD1DRD5
SCHEMBL7717797 0.70 PTGIR (0.41)
SCHEMBL537975 0.67 CA2 (0.33) DRD2DRD3DRD4
SCHEMBL7486376 0.66 DRD2 (0.58) DRD2DRD3DRD4
SCHEMBL25106735 0.66 BACE1 (0.33) DRD2DRD3HTR1DDRD4HTR5A

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
US-6384072-B1 CARBAMYL SUBSTITUTED COMPOUNDS WITH ETHER GROUPS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-05-07 US disclosed
EP-1030834-A1 BENZOCYCLOHEPTENE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-08-30 EP disclosed
WO-1999024397-A1 BENZOCYCLOHEPTENE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1999-05-20 WO disclosed