SCHEMBL11856751

SCHEMBL11856751

O=C(O)C=C(CC(=O)OC(=O)CO)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.54
TSHR P16473 1/20 0.54

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
SCHEMBL1289878 0.92 KDM4E (0.62) KDM4ETSHR
SCHEMBL6400546 0.81 KDM4E (0.50) KDM4ETSHR
SCHEMBL323453 0.80 KDM4E (0.54) KDM4ETSHR
SCHEMBL28692168 0.78 TSHR (0.47) KDM4ETSHR
SCHEMBL28942452 0.78 TSHR (0.83) KDM4ETSHR
SCHEMBL28807064 0.77 TSHR (0.50) KDM4ETSHR
SCHEMBL15741505 0.77 TSHR (0.60) KDM4ETSHR
SCHEMBL5472413 0.77 TSHR (0.60) KDM4ETSHR
SCHEMBL10259507 0.77 TSHR (0.60) KDM4ETSHR
SCHEMBL28316643 0.74 TSHR (0.52) KDM4ETSHR

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
US-3954858-A Novel sequestrant builders and method of making the same LEVER BROTHERS COMPANY (US) 1976-05-04 US disclosed