SCHEMBL7328318

SCHEMBL7328318

COC(=O)C1(OC(C)C(=O)O)CC=CS1

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
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
SCHEMBL6535202 0.74
SCHEMBL28064835 0.67 MEN1 (0.31) KMT2A
SCHEMBL3658647 0.65 NPSR1 (0.33)
SCHEMBL27395388 0.65 LMNA (0.30)
SCHEMBL24328855 0.61
SCHEMBL5800447 0.60 MEN1 (0.32) KMT2A
SCHEMBL28738277 0.60 KDM4E (0.31) KMT2A
SCHEMBL6588622 0.60 NPSR1 (0.33)
SCHEMBL13645886 0.58 NPSR1 (0.32) KMT2A
SCHEMBL29130638 0.57 TSHR (0.30)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0664805-A1 HETEROCYCLIC -ESTERS OR -AMIDES USED AS 5-HT 4? RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM PLC (GB) 1995-08-02 EP disclosed
WO-1994008994-A1 HETEROCYCLIC -ESTERS OR -AMIDES USED AS 5-HT4 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM PLC (GB) 1994-04-28 WO disclosed