SCHEMBL8622925

SCHEMBL8622925

O=C(O)COc1cccc2c(CCNS(=O)(=O)/C=C/c3ccc(Cl)cc3)cccc12

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.42
CYSLTR1 Q9Y271 2/20 0.41
LMNA P02545 1/20 0.41
ALDH1A1 P00352 2/20 0.39
KDM4E B2RXH2 1/20 0.39
HPGD P15428 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
MEN1 O00255 1/20 0.38
POLB P06746 1/20 0.38
KMT2A Q03164 1/20 0.38
PTGDR2 Q9Y5Y4 3/20 0.37
MAPT P10636 1/20 0.37
MTNR1A P48039 1/20 0.37
CASP1 P29466 1/20 0.36
CYSLTR2 Q9NS75 1/20 0.36

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
SCHEMBL8624280 1.00 GAA (0.42) GAACYSLTR1LMNAALDH1A1KDM4E
SCHEMBL8623924 0.92 GAA (0.51) GAALMNAALDH1A1KDM4EHPGD
SCHEMBL8625020 0.92 GAA (0.51) GAALMNAALDH1A1KDM4EHPGD
SCHEMBL8624132 0.89 MTNR1A (0.42) GAALMNAALDH1A1KDM4EHPGD
SCHEMBL8624129 0.89 MTNR1A (0.42) GAALMNAALDH1A1KDM4EHPGD
SCHEMBL8623815 0.86 GAA (0.55) GAACYSLTR1LMNAALDH1A1KDM4E
SCHEMBL8623814 0.86 GAA (0.55) GAACYSLTR1LMNAALDH1A1KDM4E
SCHEMBL8624755 0.84 GAA (0.46) GAALMNAALDH1A1KDM4EHPGD
SCHEMBL8623518 0.84 GAA (0.46) GAALMNAALDH1A1KDM4EHPGD
SCHEMBL8624768 0.83 PTGDR2 (0.42) ALDH1A1KDM4EHPGDTDP1MEN1

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 5 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
EP-0657422-B1 Naphthyloxyacetic acid derivatives as PGE2 agonists and antagonists ONO PHARMACEUTICAL CO (JP) 1998-06-10 EP 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
EP-0657422-A1 Naphthyloxyacetic acid derivatives as PGE2 agonists and antagonists ONO PHARMACEUTICAL CO., LTD. (JP) 1995-06-14 EP disclosed