SCHEMBL4820067

SCHEMBL4820067

CC1(C)CCN(C(=O)Cc2ccc(C(C)(C)C)cc2)C1

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 2/20 0.48
PANK3 Q9H999 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.43
HRH3 Q9Y5N1 2/20 0.43
KCNH2 Q12809 1/20 0.42
CACNA1I Q9P0X4 1/20 0.42
CRBN Q96SW2 1/20 0.41
RORC P51449 1/20 0.41

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
SCHEMBL4820081 1.00 HSD11B1 (0.48) HSD11B1PANK3SMN1; SMN2HRH3KCNH2
SCHEMBL14297333 0.84 MEN1 (0.56) HSD11B1SMN1; SMN2
SCHEMBL4817865 0.82 HSD11B1 (0.68) HSD11B1SMN1; SMN2RORC
SCHEMBL4817875 0.82 HSD11B1 (0.68) HSD11B1SMN1; SMN2RORC
SCHEMBL4819767 0.82 CRBN (0.58) HSD11B1SMN1; SMN2CRBN
SCHEMBL4819750 0.82 CRBN (0.58) HSD11B1SMN1; SMN2CRBN
SCHEMBL15317641 0.80 SMN1; SMN2 (0.61) PANK3SMN1; SMN2HRH3
SCHEMBL4814889 0.80 MAPT (0.59) HSD11B1SMN1; SMN2HRH3CRBN
SCHEMBL22800968 0.78 HPGD (0.61) HSD11B1PANK3SMN1; SMN2HRH3KCNH2
SCHEMBL15317673 0.78 MAPT (0.64) HSD11B1PANK3SMN1; SMN2HRH3KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7402606-B2 Derivatives of 1-(oxoaminoacetyl) pentylcarbamate as cathepsin K inhibitors for the treatment of bone loss SMITHKLINE BEECHAM CORPORATION (US) 2008-07-22 US claimed
EP-1494663-A1 DERIVATIVES OF 1-(OXOAMINOACETYL) PENTYLCARBAMATE AS CATHEPSIN K INHIBITORS FOR THE TREATMENT OF BONE LOSS SmithKline Beecham Corporation (US) 2005-01-12 EP claimed
WO-2003086385-A1 DERIVATIVES OF 1-(OXOAMINOACETYL) PENTYLCARBAMATE AS CATHEPSIN K INHIBITORS FOR THE TREATMENT OF BONE LOSS SMITHKLINE BEECHAM CORPORATION (US) 2003-10-23 WO claimed
US-7402606-B2 Derivatives of 1-(oxoaminoacetyl) pentylcarbamate as cathepsin K inhibitors for the treatment of bone loss SMITHKLINE BEECHAM CORPORATION (US) 2008-07-22 US disclosed
EP-1494663-A1 DERIVATIVES OF 1-(OXOAMINOACETYL) PENTYLCARBAMATE AS CATHEPSIN K INHIBITORS FOR THE TREATMENT OF BONE LOSS SmithKline Beecham Corporation (US) 2005-01-12 EP disclosed
WO-2003086385-A1 DERIVATIVES OF 1-(OXOAMINOACETYL) PENTYLCARBAMATE AS CATHEPSIN K INHIBITORS FOR THE TREATMENT OF BONE LOSS SMITHKLINE BEECHAM CORPORATION (US) 2003-10-23 WO disclosed