SCHEMBL2841154

SCHEMBL2841154

CN1CCN(C(CNS(=O)(=O)c2ccc(Oc3ccccc3)cc2)c2ccccc2C(F)(F)F)CC1

nearest known ligand 0.57

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ MC4R P32245 2/20 0.49
▸ TSHR P16473 1/20 0.47
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ MAPT P10636 2/20 0.43
▸ GAA P10253 1/20 0.42

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
SCHEMBL2844709 0.87 MC4R (0.66) MC4RTSHRL3MBTL1GAA
SCHEMBL2839209 0.87 TSHR (0.48) MC4RTSHRL3MBTL1MAPTGAA
SCHEMBL2842779 0.86 L3MBTL1 (0.51) MC4RTSHRL3MBTL1GAA
SCHEMBL2839988 0.85 MC4R (0.49) MC4RTSHRL3MBTL1GAA
SCHEMBL2842406 0.85 GAA (0.56) MC4RTSHRL3MBTL1MAPTGAA
SCHEMBL2839986 0.85 MC4R (0.49) MC4RTSHRL3MBTL1GAA
SCHEMBL2840401 0.85 MC4R (0.49) MC4RTSHRL3MBTL1GAA
SCHEMBL2843841 0.85 MC4R (0.49) MC4RTSHRL3MBTL1GAA
SCHEMBL2838266 0.85 MC4R (0.57) MC4RTSHRL3MBTL1MAPTGAA
SCHEMBL2846286 0.85 CCR3 (0.55) TSHRL3MBTL1GAA

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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