SCHEMBL1906513

SCHEMBL1906513

O=C(O)c1c(-c2ccc(Cl)cc2)csc1NCC(Cl)Cc1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ ANO1 Q5XXA6 19/20 0.56
▸ ANO2 Q9NQ90 1/20 0.48
▸ MEN1 O00255 1/20 0.48
▸ KMT2A Q03164 1/20 0.48

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
SCHEMBL1952323 0.82 ANO1 (0.61) ANO1ANO2MEN1KMT2A
SCHEMBL1905629 0.79 ANO1 (0.60) ANO1ANO2MEN1KMT2A
SCHEMBL1907122 0.79 ANO1 (0.60) ANO1ANO2MEN1KMT2A
SCHEMBL1954662 0.77 ANO1 (0.63) ANO1ANO2MEN1KMT2A
SCHEMBL1954508 0.77 ANO1 (0.57) ANO1ANO2MEN1KMT2A
SCHEMBL1954070 0.75 ANO1 (0.61) ANO1ANO2MEN1KMT2A
SCHEMBL1954102 0.75 ANO1 (0.61) ANO1ANO2MEN1KMT2A
SCHEMBL12271278 0.75 ANO1 (0.80) ANO1ANO2MEN1KMT2A
SCHEMBL1954635 0.74 ANO1 (0.60) ANO1ANO2MEN1KMT2A
SCHEMBL1894210 0.74 ANO1 (0.51) ANO1ANO2MEN1KMT2A

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-2321303-A2 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM Calcimedica, Inc. (US) 2011-05-18 — — EP disclosed
WO-2010027875-A2 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM CALCIMEDICA INC. (US) 2010-03-11 — — WO disclosed
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