SCHEMBL7716620

SCHEMBL7716620

CC(C)(C)[Si](Oc1cccc2c1CCCC(OS(=O)(=O)C(F)(F)F)=C2)(c1ccccc1)c1ccccc1

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 11/20 0.34
DRD3 P35462 9/20 0.34
DRD4 P21917 7/20 0.34
HTR1D P28221 2/20 0.32
DRD1 P21728 5/20 0.32
DRD5 P21918 5/20 0.32
HTR5A P47898 1/20 0.32

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
SCHEMBL22557845 0.81 DRD2 (0.39) DRD2DRD3DRD4HTR1DDRD1
SCHEMBL7720307 0.78 DRD2 (0.35) DRD2DRD3DRD4HTR1DDRD1
SCHEMBL7717808 0.75 PTGIR (0.31)
SCHEMBL7717824 0.74 CA12 (0.38)
SCHEMBL29398439 0.74 DRD2 (0.41) DRD2DRD3DRD4HTR1DDRD1
SCHEMBL22557831 0.74 DRD2 (0.41) DRD2DRD3DRD4HTR1DDRD1
SCHEMBL8078312 0.73 DRD2 (0.33) DRD2DRD3DRD4DRD1DRD5
SCHEMBL22568962 0.72 DRD2 (0.38) DRD2DRD3DRD4HTR1DDRD1
SCHEMBL7487183 0.72 ADRB2 (0.46)
SCHEMBL7779651 0.70 PTGIR (0.35)

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