SCHEMBL13769760

SCHEMBL13769760

CC(C)(C)OC(=O)N1CCC(c2cccnc2Oc2cccc(F)c2F)CC1

nearest known ligand 0.60

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 4/20 0.60
SLC6A2 P23975 4/20 0.60
SLC6A4 P31645 4/20 0.60
PDE10A Q9Y233 1/20 0.54
GPR119 Q8TDV5 5/20 0.49
SLC6A3 Q01959 1/20 0.46
MAPT P10636 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
LMNA P02545 1/20 0.46

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
SCHEMBL13770041 0.92 HTR1A (0.58) HTR1ASLC6A2SLC6A4PDE10AGPR119
SCHEMBL4003945 0.90 HTR1A (0.56) HTR1ASLC6A2SLC6A4PDE10AGPR119
SCHEMBL4014582 0.89 HTR1A (0.62) HTR1ASLC6A2SLC6A4PDE10AGPR119
SCHEMBL13769478 0.87 HTR1A (0.60) HTR1ASLC6A2SLC6A4PDE10AGPR119
SCHEMBL4013499 0.87 PDE10A (0.53) HTR1ASLC6A2SLC6A4PDE10AGPR119
SCHEMBL4007428 0.87 HTR1A (0.65) HTR1ASLC6A2SLC6A4SLC6A3
SCHEMBL13770274 0.87 HTR1A (0.61) HTR1ASLC6A2SLC6A4PDE10AGPR119
SCHEMBL13769480 0.86 HTR1A (0.60) HTR1ASLC6A2SLC6A4PDE10AGPR119
SCHEMBL13769613 0.85 PDE10A (0.59) HTR1ASLC6A2SLC6A4PDE10AGPR119
SCHEMBL13769755 0.85 PDE10A (0.59) HTR1ASLC6A2SLC6A4PDE10AGPR119

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
WO-2009081259-A1 PHENOXY-PYRIDYL DERIVATIVES PFIZER INC. (US) 2009-07-02 WO disclosed