SCHEMBL8626276

SCHEMBL8626276

O=C(O)COc1cccc2cc(NS(=O)(=O)/C=C/c3ccccc3)ccc12

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.51
KDM4E B2RXH2 3/20 0.51
TDP1 Q9NUW8 2/20 0.51
HPGD P15428 2/20 0.51
KMT2A Q03164 6/20 0.50
MEN1 O00255 4/20 0.50
POLB P06746 2/20 0.50
GAA P10253 1/20 0.50
HSD17B10 Q99714 1/20 0.50
PKM P14618 1/20 0.48
MAPT P10636 2/20 0.47
TYMS P04818 1/20 0.47
LMNA P02545 4/20 0.46
HTT P42858 1/20 0.43
DAPK1 P53355 1/20 0.43
PIM3 Q86V86 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.42
OGG1 O15527 1/20 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
SCHEMBL8604312 1.00 ALDH1A1 (0.51) ALDH1A1KDM4ETDP1HPGDKMT2A
SCHEMBL8602035 0.83 KDM4E (0.49) ALDH1A1KDM4ETDP1HPGDKMT2A
SCHEMBL8600099 0.83 ALDH1A1 (0.51) ALDH1A1KDM4ETDP1HPGDKMT2A
SCHEMBL8624943 0.82 GAA (0.47) ALDH1A1KDM4ETDP1HPGDKMT2A
SCHEMBL8624947 0.82 GAA (0.47) ALDH1A1KDM4ETDP1HPGDKMT2A
SCHEMBL8600090 0.80 ALDH1A1 (0.55) ALDH1A1KDM4ETDP1HPGDKMT2A
SCHEMBL8626804 0.80 ALDH1A1 (0.55) ALDH1A1KDM4ETDP1HPGDKMT2A
SCHEMBL8624758 0.78 ALDH1A1 (0.50) ALDH1A1KDM4ETDP1HPGDKMT2A
SCHEMBL8604536 0.74 MAPT (0.55) ALDH1A1KDM4ETDP1HPGDKMT2A
SCHEMBL8604212 0.74 GAA (0.47) ALDH1A1KDM4ETDP1HPGDKMT2A

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