SCHEMBL8600745

SCHEMBL8600745

CC(=O)Oc1cccc2c1CCC(CNS(=O)(=O)C=Cc1ccccc1)C2

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PTGIR P43119 13/20 0.40
GAA P10253 1/20 0.39
MTNR1A P48039 1/20 0.39
MTNR1B P49286 1/20 0.39
CHRM2 P08172 1/20 0.38
CHRM1 P11229 1/20 0.38
CHRM3 P20309 1/20 0.38
ALDH1A1 P00352 1/20 0.38
MAPT P10636 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
ACHE P22303 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
SCHEMBL8600743 0.87 PTGIR (0.55) PTGIR
SCHEMBL8414288 0.74 MTNR1A (0.48) PTGIRMTNR1AMTNR1BCHRM2CHRM1
SCHEMBL8414324 0.73 MTNR1A (0.47) PTGIRMTNR1AMTNR1BCHRM2CHRM1
SCHEMBL8812824 0.73 PTGIR (0.47) PTGIRMTNR1AMTNR1BCHRM2CHRM1
SCHEMBL8602824 0.71 PTGIR (0.50) PTGIRCA1CA2ACHE
SCHEMBL8602826 0.71 PTGIR (0.50) PTGIRCA1CA2ACHE
SCHEMBL9045690 0.70 CHRM2 (0.48) PTGIRMTNR1AMTNR1BCHRM2CHRM1
SCHEMBL8811681 0.70 PTGIR (0.47) PTGIRMTNR1AMTNR1BCHRM2CHRM1
SCHEMBL9045695 0.68 MTNR1A (0.44) PTGIRMTNR1AMTNR1BCHRM2CHRM1
SCHEMBL9017303 0.67 DRD2 (0.67) MTNR1AMTNR1BCHRM2CHRM1CHRM3

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0657422-B1 Naphthyloxyacetic acid derivatives as PGE2 agonists and antagonists ONO PHARMACEUTICAL CO (JP) 1998-06-10 EP claimed
EP-0657422-A1 Naphthyloxyacetic acid derivatives as PGE2 agonists and antagonists ONO PHARMACEUTICAL CO., LTD. (JP) 1995-06-14 EP claimed
US-5723493-A PROSTAGLANDIN DERIVATIVES ONO PHARMACEUTICAL CO., LTD. (JP) 1998-03-03 US disclosed
US-5624959-A INHIBITING UTERINE CONTRACTIONS, PROSTAGLANDIN ANTAGONIST OR AGONIST, ANALGESICS AND ANTISECRETORY AGENTS ONO PHARMACEUTICAL CO., LTD. (JP) 1997-04-29 US disclosed