SCHEMBL8650644

SCHEMBL8650644

C/C(=C/C(=O)OC(=O)CC(=CC(=O)O)C(=O)O)C(=O)OC(=O)CC(=CC(=O)O)C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.44
TSHR P16473 1/20 0.44
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL6273434 0.90 KDM4E (0.50) KDM4ETSHR
SCHEMBL323453 0.79 KDM4E (0.54) KDM4ETSHR
SCHEMBL1679950 0.79 ALOX15 (0.35) MEN1KMT2A
SCHEMBL1289878 0.78 KDM4E (0.62) KDM4ETSHR
SCHEMBL28807064 0.76 TSHR (0.50) KDM4ETSHR
SCHEMBL17763308 0.75 NPSR1 (0.33) MEN1KMT2A
SCHEMBL11853696 0.73
SCHEMBL11868324 0.73 KDM4E (0.43) KDM4ETSHR
SCHEMBL15741505 0.73 TSHR (0.60) KDM4ETSHRMEN1KMT2A
SCHEMBL5804761 0.73 HTT (0.32) MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0864639-A2 A crystalline calcium carbonate builder encapsulated with a hydrotrope for use in detergent compositions THE PROCTER & GAMBLE COMPANY (US) 1998-09-16 EP disclosed