SCHEMBL13769764

SCHEMBL13769764

COc1cccc(Cl)c1Oc1ncccc1C1CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 1/20 0.51
HTR1A P08908 5/20 0.48
SLC6A2 P23975 5/20 0.48
SLC6A4 P31645 5/20 0.48
SLC6A3 Q01959 5/20 0.48
GPR119 Q8TDV5 1/20 0.46
ALDH1A1 P00352 1/20 0.45
LMNA P02545 1/20 0.45
JAK2 O60674 2/20 0.45
JAK3 P52333 2/20 0.45
PTK2 Q05397 2/20 0.45
POLB P06746 1/20 0.45
STS P08842 1/20 0.44
FNTA P49354 1/20 0.44
FNTB P49356 1/20 0.44
MAPT P10636 1/20 0.43

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
SCHEMBL4014582 0.89 HTR1A (0.62) PDE10AHTR1ASLC6A2SLC6A4SLC6A3
SCHEMBL4008350 0.89 HTR1A (0.60) PDE10AHTR1ASLC6A2SLC6A4SLC6A3
SCHEMBL13769480 0.88 HTR1A (0.60) PDE10AHTR1ASLC6A2SLC6A4SLC6A3
SCHEMBL4004459 0.88 HTR1A (0.52) HTR1ASLC6A2SLC6A4SLC6A3
SCHEMBL13769755 0.88 PDE10A (0.59) PDE10AHTR1ASLC6A2SLC6A4SLC6A3
SCHEMBL17384582 0.83 GPR119 (0.58) PDE10AGPR119ALDH1A1JAK2JAK3
SCHEMBL4003945 0.83 HTR1A (0.56) PDE10AHTR1ASLC6A2SLC6A4SLC6A3
SCHEMBL4011369 0.83 PDE10A (0.52) PDE10AHTR1ASLC6A2SLC6A4SLC6A3
SCHEMBL4015037 0.82 PDE10A (0.51) PDE10AHTR1ASLC6A2SLC6A4SLC6A3
SCHEMBL13769613 0.82 PDE10A (0.59) PDE10AHTR1ASLC6A2SLC6A4SLC6A3

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