SCHEMBL7943197

SCHEMBL7943197

C=C(Nc1scc(-c2ccc(Cl)cc2)c1C(=O)O)C1CC(=O)c2ccccc2C1

nearest known ligand 0.54

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ ANO1 Q5XXA6 18/20 0.54
▸ MEN1 O00255 2/20 0.47
▸ KMT2A Q03164 2/20 0.47
▸ ANO2 Q9NQ90 1/20 0.46

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
SCHEMBL1951579 0.90 ANO1 (0.56) ANO1MEN1KMT2AANO2
SCHEMBL12830907 0.84 ANO1 (0.37) ANO1MEN1KMT2A
SCHEMBL1954030 0.81 ANO1 (0.63) ANO1MEN1KMT2AANO2
SCHEMBL1953124 0.77 ANO1 (0.57) ANO1MEN1KMT2AANO2
SCHEMBL1907652 0.77 ANO1 (0.57) ANO1MEN1KMT2AANO2
SCHEMBL1951883 0.77 ANO1 (0.57) ANO1MEN1KMT2AANO2
SCHEMBL12756759 0.76 NPY5R (0.41) ANO1MEN1KMT2A
SCHEMBL1908451 0.75 ANO1 (0.56) ANO1MEN1KMT2AANO2
SCHEMBL1954708 0.75 ANO1 (0.56) ANO1MEN1KMT2AANO2
SCHEMBL13819661 0.74 MEN1 (0.69) ANO1MEN1KMT2A

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
WO-2010027875-A2 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM CALCIMEDICA INC. (US) 2010-03-11 — — WO disclosed
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