SCHEMBL8315002

SCHEMBL8315002

COC(=O)CS(=O)(=O)NC1CC2(CCNCC2)c2ccccc21

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NAE1 Q13564 5/20 0.39
UBA3 Q8TBC4 5/20 0.39
MCHR2 Q969V1 8/20 0.36
DRD2 P14416 2/20 0.35
SLC6A4 P31645 2/20 0.35
SIGMAR1 Q99720 2/20 0.34
UBA1 P22314 1/20 0.34
EGFR P00533 1/20 0.33
KCNH2 Q12809 1/20 0.33
OPRM1 P35372 2/20 0.33
CYP3A4 P08684 1/20 0.32
LPAR1 Q92633 1/20 0.32

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
SCHEMBL8312220 0.80 NAE1 (0.47) NAE1UBA3UBA1
SCHEMBL8310625 0.80 NAE1 (0.38) NAE1UBA3MCHR2DRD2SLC6A4
SCHEMBL1222483 0.77 HSD11B1 (0.43) MCHR2SIGMAR1EGFROPRM1CYP3A4
SCHEMBL12084760 0.75 MCHR2 (0.53) NAE1UBA3MCHR2DRD2SLC6A4
SCHEMBL7632592 0.75 MCHR2 (0.53) NAE1UBA3MCHR2DRD2SLC6A4
SCHEMBL652661 0.74 OPRM1 (0.43) NAE1UBA3MCHR2DRD2SLC6A4
SCHEMBL12084784 0.74 OPRM1 (0.43) NAE1UBA3MCHR2DRD2SLC6A4
SCHEMBL8100165 0.73 MCHR2 (0.42) NAE1UBA3MCHR2DRD2SLC6A4
SCHEMBL14272835 0.73 SIGMAR1 (0.40) NAE1UBA3MCHR2SIGMAR1KCNH2
SCHEMBL30488771 0.73 SIGMAR1 (0.40) NAE1UBA3MCHR2SIGMAR1KCNH2

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
EP-0662481-B1 Spiro piperidines and homologs promote release of growth hormone MERCK & CO INC (US) 1999-03-24 EP disclosed
US-5578593-A RELEASING GROWTH HORMONES FOR ANIMALS MERCK & CO., INC. (US) 1996-11-26 US disclosed
EP-0662481-A1 Spiro piperidines and homologs promote release of growth hormone MERCK & CO. INC. (US) 1995-07-12 EP disclosed