SCHEMBL13381546

SCHEMBL13381546

CC1CCN(C(CNS(=O)(=O)c2ccc(Oc3ccccc3)cc2)c2ccc(O)c(O)c2)CC1

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 1/20 0.47
▸ ALDH1A1 P00352 2/20 0.43
▸ GLA P06280 1/20 0.43
▸ MAPT P10636 1/20 0.43
▸ GAA P10253 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ MEN1 O00255 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ HTT P42858 1/20 0.40
▸ KMT2A Q03164 1/20 0.40

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
SCHEMBL13381969 0.89 L3MBTL1 (0.48) L3MBTL1ALDH1A1GLAMAPTGAA
SCHEMBL13381695 0.89 L3MBTL1 (0.50) L3MBTL1ALDH1A1GAA
SCHEMBL13381525 0.89 ADAM33 (0.47) L3MBTL1ALDH1A1GLAMAPTGAA
SCHEMBL2841104 0.85 TP53 (0.47) L3MBTL1LMNAKMT2A
SCHEMBL13381499 0.81 ALDH1A1 (0.45) L3MBTL1ALDH1A1GAA
SCHEMBL13381614 0.80 MAPT (0.49) L3MBTL1ALDH1A1GLAMAPTGAA
SCHEMBL13381621 0.80 TSHR (0.58) ALDH1A1MAPTLMNA
SCHEMBL13381505 0.80 TSHR (0.60) ALDH1A1LMNA
SCHEMBL13381741 0.80 MMP2 (0.42) L3MBTL1MAPTMEN1LMNAHTT
SCHEMBL13381622 0.79 GAA (0.52) L3MBTL1ALDH1A1MAPTGAA

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-2010039911-A1 CALCILYTIC COMPOUNDS GLAXOSMITHKLINE LLC (US) 2010-04-08 — — WO disclosed
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