SCHEMBL7203695

SCHEMBL7203695

CN(C)CC#CCC1CCC(N(C)C(=O)Oc2ccc(Cl)cc2)CC1

nearest known ligand 0.56

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LSS P48449 10/20 0.56
ACHE P22303 2/20 0.38
TACR3 P29371 5/20 0.37
LMNA P02545 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36

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
SCHEMBL7202905 0.88 LSS (0.69) LSSACHE
SCHEMBL7210422 0.87 LSS (0.56) LSSACHE
SCHEMBL4805082 0.85 LSS (0.68) LSSACHETACR3LMNAL3MBTL1
SCHEMBL4805079 0.85 LSS (0.68) LSSACHETACR3LMNAL3MBTL1
SCHEMBL4797901 0.82 LSS (0.63) LSSACHELMNAL3MBTL1
SCHEMBL4797907 0.82 LSS (0.63) LSSACHELMNAL3MBTL1
SCHEMBL4804058 0.79 LSS (0.69) LSSACHELMNAL3MBTL1
SCHEMBL4804067 0.79 LSS (0.69) LSSACHELMNAL3MBTL1
SCHEMBL4797476 0.78 LSS (0.57) LSSACHETACR3LMNAL3MBTL1
SCHEMBL4797473 0.78 LSS (0.57) LSSACHETACR3LMNAL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1311475-A1 NOVEL AMINOCYCLOHEXANE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2003-05-21 EP disclosed
WO-2002014267-A1 NOVEL AMINOCYCLOHEXANE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2002-02-21 WO disclosed