SCHEMBL2837131

SCHEMBL2837131

CN1CCN(C(CNS(=O)(=O)c2ccc(Oc3ccccc3)cc2)c2cccc(Oc3ccccc3)c2)CC1

nearest known ligand 0.67

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 1/20 0.56
▸ TSHR P16473 1/20 0.55
▸ GAA P10253 2/20 0.52
▸ ALDH1A1 P00352 3/20 0.52
▸ GLA P06280 1/20 0.50

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
SCHEMBL2846692 0.94 L3MBTL1 (0.62) L3MBTL1TSHRGAAALDH1A1GLA
SCHEMBL2838490 0.93 L3MBTL1 (0.53) L3MBTL1TSHRGAAALDH1A1GLA
SCHEMBL2843777 0.92 ALDH1A1 (0.54) L3MBTL1TSHRGAAALDH1A1GLA
SCHEMBL2840539 0.92 L3MBTL1 (0.52) L3MBTL1TSHRGAAALDH1A1GLA
SCHEMBL2847484 0.91 L3MBTL1 (0.59) L3MBTL1TSHRGAAALDH1A1GLA
SCHEMBL2843660 0.90 L3MBTL1 (0.52) L3MBTL1TSHRGAAALDH1A1
SCHEMBL2838351 0.90 ALDH1A1 (0.51) L3MBTL1TSHRGAAALDH1A1GLA
SCHEMBL13381695 0.88 L3MBTL1 (0.50) L3MBTL1TSHRGAAALDH1A1
SCHEMBL2843891 0.88 L3MBTL1 (0.50) L3MBTL1TSHRGAAALDH1A1GLA
SCHEMBL2837645 0.88 TSHR (0.54) L3MBTL1TSHRGAAALDH1A1GLA

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

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