SCHEMBL2843205

SCHEMBL2843205

CN1CCN(C(CNS(=O)(=O)c2ccc(Oc3ccccc3)cc2)c2ccc(Br)cc2)CC1

nearest known ligand 0.72

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.55
▸ L3MBTL1 Q9Y468 1/20 0.55
▸ TSHR P16473 1/20 0.52
▸ GAA P10253 2/20 0.51
▸ ALDH1A1 P00352 2/20 0.49
▸ GLA P06280 1/20 0.49
▸ TP53 P04637 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
SCHEMBL2847484 0.95 L3MBTL1 (0.59) MAPTL3MBTL1TSHRGAAALDH1A1
SCHEMBL2846692 0.93 L3MBTL1 (0.62) L3MBTL1TSHRGAAALDH1A1GLA
SCHEMBL2842383 0.91 L3MBTL1 (0.56) MAPTL3MBTL1TSHRGAAALDH1A1
SCHEMBL2846591 0.91 L3MBTL1 (0.66) MAPTL3MBTL1TSHRGAAALDH1A1
SCHEMBL2841062 0.91 L3MBTL1 (0.66) MAPTL3MBTL1TSHRGAAALDH1A1
SCHEMBL2843768 0.90 ALDH1A1 (0.62) MAPTL3MBTL1TSHRGAAALDH1A1
SCHEMBL2843212 0.90 TSHR (0.64) MAPTL3MBTL1TSHRGAATP53
SCHEMBL2843771 0.90 ALDH1A1 (0.62) MAPTL3MBTL1TSHRGAAALDH1A1
SCHEMBL2841026 0.90 ALDH1A1 (0.62) MAPTL3MBTL1TSHRGAAALDH1A1
SCHEMBL2840539 0.89 L3MBTL1 (0.52) 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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