SCHEMBL5239690

SCHEMBL5239690

Nc1ccc(OCCC2CCCN2)c(Cl)c1

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SSTR2 P30874 7/20 0.41
MKNK1 Q9BUB5 1/20 0.40
SLC6A2 P23975 1/20 0.39
SLC6A4 P31645 1/20 0.39
LTA4H P09960 1/20 0.39
CHRNA3 P32297 3/20 0.39
CHRNB4 P30926 1/20 0.39
PRKCZ Q05513 1/20 0.39
HSP90AA1 P07900 1/20 0.38
HSP90AB1 P08238 1/20 0.38
HPGD P15428 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
SCHEMBL4705249 0.84 SLC6A2 (0.39) MKNK1SLC6A2CHRNA3CHRNB4PRKCZ
SCHEMBL12491869 0.84 CHRNB4 (0.39) MKNK1CHRNA3CHRNB4PRKCZHPGD
SCHEMBL7006966 0.83 CHRNB4 (0.55) SSTR2CHRNA3CHRNB4PRKCZ
SCHEMBL2172629 0.83 CHRNB4 (0.51) SSTR2CHRNA3CHRNB4PRKCZHPGD
SCHEMBL5240271 0.82 CHEK2 (0.51) SSTR2MKNK1CHRNA3CHRNB4HSP90AA1
SCHEMBL11459124 0.81 SLC6A2 (0.53) SLC6A2SLC6A4LTA4HCHRNA3CHRNB4
SCHEMBL6645965 0.80 CHRNB4 (0.44) SSTR2MKNK1CHRNA3CHRNB4PRKCZ
SCHEMBL6073607 0.80 CHRNB4 (0.47) SSTR2CHRNA3CHRNB4HSP90AA1HSP90AB1
SCHEMBL6628961 0.80 CHRNB4 (0.51) SSTR2CHRNA3CHRNB4HSP90AA1HSP90AB1
SCHEMBL5261782 0.79 PRKCZ (0.37) MKNK1LTA4HCHRNA3CHRNB4PRKCZ

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-1828207-A1 THIAZOLOPYRIDINONE DERIVATES AS MCH RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 2007-09-05 EP disclosed
WO-2006066174-A1 THIAZOLOPYRIDINONE DERIVATES AS MCH RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 2006-06-22 WO disclosed