SCHEMBL2836197

SCHEMBL2836197

COc1ccc(C(CNS(=O)(=O)c2ccc(Oc3ccccc3)cc2)N2CCN(C)CC2)c(F)c1

nearest known ligand 0.63

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ MC4R P32245 3/20 0.53
▸ L3MBTL1 Q9Y468 1/20 0.51
▸ MAPT P10636 1/20 0.48
▸ TSHR P16473 1/20 0.48
▸ ALDH1A1 P00352 1/20 0.45
▸ GAA P10253 1/20 0.45
▸ PGR P06401 1/20 0.43

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
SCHEMBL2843950 0.93 MC4R (0.53) MC4RL3MBTL1MAPTTSHRALDH1A1
SCHEMBL2843679 0.90 MC4R (0.52) MC4RL3MBTL1MAPTTSHRALDH1A1
SCHEMBL2844709 0.89 MC4R (0.66) MC4RL3MBTL1TSHRALDH1A1GAA
SCHEMBL13381944 0.88 MC4R (0.50) MC4RL3MBTL1MAPTTSHRPGR
SCHEMBL2838266 0.87 MC4R (0.57) MC4RL3MBTL1MAPTTSHRALDH1A1
SCHEMBL2842406 0.85 GAA (0.56) MC4RL3MBTL1MAPTTSHRALDH1A1
SCHEMBL2846591 0.84 L3MBTL1 (0.66) L3MBTL1MAPTTSHRALDH1A1GAA
SCHEMBL2843843 0.84 MC4R (0.52) MC4RL3MBTL1MAPTTSHRALDH1A1
SCHEMBL2837645 0.83 TSHR (0.54) MC4RL3MBTL1TSHRALDH1A1GAA
SCHEMBL2842779 0.82 L3MBTL1 (0.51) MC4RL3MBTL1TSHRALDH1A1GAA

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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