SCHEMBL8488192

SCHEMBL8488192

CNC(=O)OC1CCc2c(cccc2OCC(=O)OC)C1

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 1/20 0.44
MTNR1B P49286 1/20 0.44
PTGIR P43119 12/20 0.43
DRD2 P14416 4/20 0.43
DRD4 P21917 3/20 0.43
DRD3 P35462 3/20 0.43
CA1 P00915 2/20 0.42
CA2 P00918 2/20 0.42
ACHE P22303 2/20 0.42

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
SCHEMBL8484206 0.90 PTGIR (0.53) PTGIR
SCHEMBL8576529 0.89 MTNR1A (0.48) MTNR1AMTNR1BPTGIRDRD2DRD4
SCHEMBL9017314 0.82 MTNR1A (0.50) MTNR1AMTNR1BPTGIRDRD2DRD4
SCHEMBL9017305 0.80 MTNR1A (0.48) MTNR1AMTNR1BPTGIRDRD2DRD4
SCHEMBL8488188 0.80 MTNR1A (0.60) MTNR1AMTNR1BDRD2DRD4DRD3
SCHEMBL10464119 0.77 MTNR1A (0.74) MTNR1AMTNR1BDRD2DRD4DRD3
SCHEMBL8576525 0.77 PTGIR (0.62) PTGIR
SCHEMBL8410514 0.77 PTGIR (0.54) MTNR1AMTNR1BPTGIR
SCHEMBL9005627 0.76 PTGIR (0.45) MTNR1AMTNR1BPTGIRDRD2DRD4
SCHEMBL9005623 0.76 PTGIR (0.45) MTNR1AMTNR1BPTGIRDRD2DRD4

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
US-5863918-A HYPOTENSIVE AGENTS, ANTICOAGULANTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1999-01-26 US disclosed
US-5763489-A ANTICOAGULANTS AND HYPOTENSIVE AGENTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-06-09 US disclosed