SCHEMBL4729282

SCHEMBL4729282

CCN1CCOC(c2ccc(NS(=O)(=O)Cc3ccc(Cl)c(Cl)c3)cc2)C1

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 6/20 0.47
CCR2 P41597 2/20 0.46
KCNH2 Q12809 2/20 0.46
DRD3 P35462 1/20 0.43
MOGAT2 Q3SYC2 3/20 0.43
MGAT2 Q10469 1/20 0.43
S100A9 P06702 1/20 0.38
SIGMAR1 Q99720 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
SCHEMBL4726300 0.90 CNR2 (0.46) CNR2DRD3MOGAT2MGAT2
SCHEMBL4729519 0.89 DRD3 (0.44) CNR2CCR2KCNH2DRD3MOGAT2
SCHEMBL4726646 0.88 DRD3 (0.47) CNR2DRD3MOGAT2MGAT2
SCHEMBL4726282 0.83 MOGAT2 (0.44) CNR2KCNH2DRD3MOGAT2MGAT2
SCHEMBL4729380 0.82 MOGAT2 (0.49) CNR2DRD3MOGAT2MGAT2
SCHEMBL4726498 0.78 ALDH1A1 (0.44) CCR2KCNH2DRD3
SCHEMBL4728012 0.77 CES1 (0.48) CNR2KCNH2DRD3MOGAT2MGAT2
SCHEMBL4727610 0.77 UCHL1 (0.51) CNR2KCNH2DRD3MOGAT2MGAT2
SCHEMBL4729847 0.77 MOGAT2 (0.46) CNR2CCR2KCNH2DRD3MOGAT2
SCHEMBL4778150 0.76 PGR (0.50) CNR2DRD3

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
WO-2008026046-A1 MORPHOLINE D3 DOPAMINE ANTAGONISTS PFIZER PRODUCTS INC. (US) 2008-03-06 WO claimed
WO-2008026046-A1 MORPHOLINE D3 DOPAMINE ANTAGONISTS PFIZER PRODUCTS INC. (US) 2008-03-06 WO disclosed