SCHEMBL2844709

SCHEMBL2844709

CN1CCN(C(CNS(=O)(=O)c2ccc(Oc3ccccc3)cc2)c2ccccc2F)CC1

nearest known ligand 0.66

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ MC4R P32245 8/20 0.66
▸ TSHR P16473 1/20 0.52
▸ L3MBTL1 Q9Y468 1/20 0.48
▸ LMNA P02545 2/20 0.47
▸ ALDH1A1 P00352 1/20 0.47
▸ GAA P10253 1/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.47

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
SCHEMBL2838266 0.93 MC4R (0.57) MC4RTSHRL3MBTL1LMNAALDH1A1
SCHEMBL2843950 0.89 MC4R (0.53) MC4RTSHRL3MBTL1ALDH1A1GAA
SCHEMBL2836197 0.89 MC4R (0.53) MC4RTSHRL3MBTL1ALDH1A1GAA
SCHEMBL2842779 0.89 L3MBTL1 (0.51) MC4RTSHRL3MBTL1LMNAALDH1A1
SCHEMBL2843679 0.89 MC4R (0.52) MC4RTSHRL3MBTL1ALDH1A1GAA
SCHEMBL2843843 0.89 MC4R (0.52) MC4RTSHRL3MBTL1LMNAALDH1A1
SCHEMBL2839986 0.88 MC4R (0.49) MC4RTSHRL3MBTL1ALDH1A1GAA
SCHEMBL2839988 0.88 MC4R (0.49) MC4RTSHRL3MBTL1ALDH1A1GAA
SCHEMBL2843841 0.88 MC4R (0.49) MC4RTSHRL3MBTL1ALDH1A1GAA
SCHEMBL2842406 0.88 GAA (0.56) MC4RTSHRL3MBTL1ALDH1A1GAA

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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