SCHEMBL6158884

SCHEMBL6158884

CCCC1CCc2cc(OS(=O)(=O)C(F)(F)F)ccc2C1

nearest known ligand 0.66

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 7/20 0.58
DRD3 P35462 6/20 0.58
HTR1D P28221 3/20 0.58
CYP26A1 O43174 1/20 0.42
CYP19A1 P11511 1/20 0.42
DRD1 P21728 2/20 0.41
DRD4 P21917 2/20 0.41
DRD5 P21918 2/20 0.41

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
SCHEMBL26371404 0.90 DRD2 (0.57) DRD2DRD3HTR1DCYP19A1DRD1
SCHEMBL7796039 0.82 ITGB3 (0.54) DRD2DRD3HTR1DCYP26A1CYP19A1
SCHEMBL26371282 0.81 HTR1D (0.56) DRD2DRD3HTR1DCYP19A1DRD1
SCHEMBL9137393 0.78 DRD2 (0.48) DRD2DRD3HTR1DCYP26A1
SCHEMBL9419762 0.77 CYP19A1 (0.52) DRD2DRD3HTR1DCYP26A1CYP19A1
SCHEMBL6936763 0.76 DRD2 (0.52) DRD2DRD3HTR1D
SCHEMBL5686598 0.76 DRD2 (0.47) DRD2DRD3HTR1DDRD1DRD4
SCHEMBL5686604 0.76 DRD2 (0.47) DRD2DRD3HTR1DDRD1DRD4
SCHEMBL227204 0.76 CYP19A1 (0.52) DRD2DRD3HTR1DCYP26A1CYP19A1
SCHEMBL6749712 0.75 DRD2 (0.50) DRD2DRD3HTR1D

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
EP-1191008-B1 COMPOUND HAVING TETRAHYDRONAPHTHALENE SKELETON AND LIQUID CRYSTAL COMPOSITION CONTAINING THE SAME DAINIPPON INK & CHEMICALS (JP) 2005-02-09 EP disclosed
US-6746728-B1 SUPERIOR LIQUID CRYSTALLINITY AND CO-SOLUBILITY WITH CURRENTLY USED LIQUID CRYSTAL COMPOUNDS; TEMPERATURE RANGE OVER WHICH LIQUID CRYSTALLINITY IS SHOWN IS BROAD; THRESHOLD VOLTAGE IS LOW; CAPABLE OF HIGH SPEED RESPONSE DAINIPPON INK AND CHEMICALS, INC. (JP) 2004-06-08 US disclosed
EP-1191008-A1 COMPOUND HAVING TETRAHYDRONAPHTHALENE SKELETON AND LIQUID CRYSTAL COMPOSITION CONTAINING THE SAME DAINIPPON INK AND CHEMICALS, INC. (JP) 2002-03-27 EP disclosed