SCHEMBL7005925

SCHEMBL7005925

CC1C(OS(C)(=O)=O)C(S(C)(=O)=O)CN1Cc1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.39
NR1H2 P55055 1/20 0.38
NR1H3 Q13133 1/20 0.38
DRD2 P14416 4/20 0.36
DRD3 P35462 4/20 0.36
SLC6A4 P31645 1/20 0.36
SIGMAR1 Q99720 1/20 0.36
HRH2 P25021 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35

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
SCHEMBL6997542 0.85 SLC6A4 (0.41) MAPTNR1H2NR1H3DRD2DRD3
SCHEMBL16394026 0.85 SLC6A4 (0.41) MAPTNR1H2NR1H3DRD2DRD3
SCHEMBL19034819 0.84 MAPT (0.48) MAPTNR1H2NR1H3DRD2DRD3
SCHEMBL5744290 0.81 SLC6A4 (0.46) MAPTNR1H2NR1H3DRD2DRD3
SCHEMBL16023501 0.77 PDK1 (0.36) MAPTNR1H2NR1H3DRD2DRD3
SCHEMBL17427527 0.77 PDK1 (0.36) MAPTNR1H2NR1H3DRD2DRD3
SCHEMBL5745904 0.76 NR1H2 (0.43) MAPTNR1H2NR1H3SIGMAR1
SCHEMBL16025064 0.73 MAPT (0.54) MAPTNR1H2NR1H3HRH2
SCHEMBL7241221 0.72 SLC6A4 (0.40) NR1H2NR1H3SLC6A4SIGMAR1
SCHEMBL4193483 0.71 RECQL (0.48) DRD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1368354-A1 MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY Pfizer Products Inc. (US) 2003-12-10 EP disclosed
WO-2002070523-A1 MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY PFIZER PRODUCTS INC. (US) 2002-09-12 WO disclosed