SCHEMBL8644379

SCHEMBL8644379

O=C1c2ccccc2S(=O)(=O)N1C(CCN1CCCCC1)c1ccc(Cl)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 5/20 0.47
DRD3 P35462 3/20 0.47
DRD4 P21917 1/20 0.47
DRD5 P21918 1/20 0.47
HTR1A P08908 4/20 0.47
HTR2A P28223 3/20 0.47
HTR7 P34969 3/20 0.47
HTR6 P50406 3/20 0.47
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA9 Q16790 1/20 0.44
UTS2R Q9UKP6 4/20 0.44
CYP3A4 P08684 2/20 0.42
OPRM1 P35372 2/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2D6 P10635 1/20 0.42
TSHR P16473 1/20 0.42
CYP2C19 P33261 1/20 0.42

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
Fumaric Acid SCHEMBL8644275 0.92 UTS2R (0.46) DRD2DRD3DRD4DRD5HTR1A
SCHEMBL8648283 0.91 DRD2 (0.44) DRD2DRD3DRD4DRD5HTR1A
SCHEMBL8644510 0.90 DRD2 (0.45) DRD2DRD3DRD4DRD5HTR1A
SCHEMBL8644873 0.89 DRD2 (0.48) DRD2DRD3DRD4DRD5HTR1A
SCHEMBL8643939 0.86 DRD2 (0.49) DRD2DRD3DRD4DRD5HTR1A
Fumaric Acid SCHEMBL8647009 0.84 NPC1 (0.43) DRD2DRD3DRD4DRD5HTR1A
Fumaric Acid SCHEMBL8650993 0.83 NPC1 (0.42) DRD2DRD3DRD4DRD5HTR1A
Fumaric Acid SCHEMBL8646610 0.83 DRD2 (0.43) DRD2DRD3DRD4DRD5HTR1A
SCHEMBL8649737 0.81 NPC1 (0.49) DRD2DRD3DRD4DRD5HTR1A
Fumaric Acid SCHEMBL8649719 0.80 HTR1A (0.44) DRD2HTR1AHTR2AHTR7HTR6

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-5773437-A UROGENITAL DISORDERS SUCH AS DYSURIA NIPPON CHEMIPHAR CO., LTD. (JP) 1998-06-30 US disclosed