SCHEMBL4726489

SCHEMBL4726489

CCN1CCOC(c2ccc(NS(=O)(=O)c3ccc(OC)c(F)c3)cc2)C1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 6/20 0.47
MAPT P10636 7/20 0.46
ALDH1A1 P00352 8/20 0.44
KMT2A Q03164 5/20 0.44
MEN1 O00255 4/20 0.44
TP53 P04637 3/20 0.44
MAPK1 P28482 1/20 0.42
HTT P42858 2/20 0.42
NPSR1 Q6W5P4 2/20 0.42
THRB P10828 1/20 0.41
PKM P14618 1/20 0.41
TSHR P16473 1/20 0.41
KIT P10721 2/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 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
SCHEMBL4727043 0.89 GFER (0.48) LMNAMAPTALDH1A1KMT2AMEN1
SCHEMBL4729811 0.84 ALDH1A1 (0.50) LMNAMAPTALDH1A1KMT2AMEN1
SCHEMBL4779866 0.84 DRD3 (0.49) LMNAALDH1A1KMT2AMEN1MAPK1
SCHEMBL4727067 0.83 TP53 (0.44) LMNAMAPTTP53THRB
SCHEMBL4725295 0.82 SMN1; SMN2 (0.55) LMNAALDH1A1KMT2AMEN1TP53
SCHEMBL4727053 0.82 LMNA (0.52) LMNAMAPTALDH1A1KMT2AMEN1
SCHEMBL4726021 0.81 LMNA (0.54) LMNATP53HTTNPSR1
SCHEMBL4779869 0.81 SMN1; SMN2 (0.51) LMNAMAPTALDH1A1KMT2AMEN1
SCHEMBL4725768 0.81 MAPT (0.51) LMNAMAPTALDH1A1KMT2ATP53
SCHEMBL4726498 0.81 ALDH1A1 (0.44) LMNAMAPTALDH1A1KMT2AMEN1

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