SCHEMBL7667692

SCHEMBL7667692

O=S(=O)(Oc1ccc(-c2ccc(C3CCCCC3)cc2)cc1)C(F)(F)F

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 4/20 0.56
DRD1 P21728 4/20 0.56
DRD4 P21917 4/20 0.56
DRD5 P21918 4/20 0.56
DRD3 P35462 4/20 0.56
LMNA P02545 1/20 0.41
HTT P42858 1/20 0.41
KMT2A Q03164 2/20 0.40
HSP90AA1 P07900 1/20 0.40
GAA P10253 1/20 0.40
MAPT P10636 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C9 P11712 1/20 0.40
KIF11 P52732 1/20 0.40
THRB P10828 1/20 0.39
KDM1A O60341 1/20 0.39
MEN1 O00255 1/20 0.38
CA12 O43570 2/20 0.38
ENPP1 P22413 1/20 0.38

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
SCHEMBL9957718 0.95 DRD2 (0.60) DRD2DRD1DRD4DRD5DRD3
SCHEMBL3128608 0.94 DRD2 (0.61) DRD2DRD1DRD4DRD5DRD3
SCHEMBL22444698 0.87 DRD2 (0.57) DRD2DRD1DRD4DRD5DRD3
SCHEMBL15726684 0.83 DRD2 (0.51) DRD2DRD1DRD4DRD5DRD3
SCHEMBL21332379 0.81 DRD2 (0.47) DRD2DRD1DRD4DRD5DRD3
SCHEMBL18399880 0.81 DRD2 (0.49) DRD2DRD1DRD4DRD5DRD3
SCHEMBL1628514 0.81 DRD2 (0.49) DRD2DRD1DRD4DRD5DRD3
SCHEMBL10179906 0.81 DRD2 (0.49) DRD2DRD1DRD4DRD5DRD3
SCHEMBL13898699 0.80 DRD2 (0.46) DRD2DRD1DRD4DRD5DRD3
SCHEMBL7139493 0.80 DRD2 (0.51) DRD2DRD1DRD4DRD5DRD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6388146-B1 AROMATIC UNSATURATED NOMONER SHARP KABUSHIKI KAISHA (JP) 2002-05-14 US disclosed