SCHEMBL5081028

SCHEMBL5081028

NC(=O)C1(CC2CC2)CC1

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.44
TDP1 Q9NUW8 1/20 0.38
ALOX5 P09917 3/20 0.37
PLG P00747 1/20 0.32
PLAT P00750 1/20 0.32
LMNA P02545 1/20 0.32
SLC1A3 P43003 2/20 0.31
SLC1A2 P43004 2/20 0.31
SLC1A1 P43005 2/20 0.31

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
SCHEMBL7416623 0.91 ALOX5 (0.41) HSD11B1TDP1ALOX5SLC1A3SLC1A2
SCHEMBL3543709 0.78 SLC6A9 (0.40) HSD11B1
SCHEMBL29953092 0.78 CYP2C19 (0.38) HSD11B1TDP1PLGPLATLMNA
SCHEMBL14323007 0.76 HSD11B1 (0.33) HSD11B1
SCHEMBL27937797 0.73 POLB (0.32) HSD11B1PLGPLATLMNA
SCHEMBL1053596 0.70 CYP2C19 (0.45) PLGPLATLMNA
SCHEMBL7421923 0.70 CYP2C19 (0.40) ALOX5LMNASLC1A3SLC1A2SLC1A1
SCHEMBL2035852 0.69
SCHEMBL1751322 0.69
SCHEMBL1515270 0.69

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-2008072077-A2 COMBINATION OF 1-ARYL-4-CYCLOPROPYLPYRAZOLES WITH ANTHELMINTIC AGENT FOR PARASITIC INFESTATION PFIZER LIMITED (GB) 2008-06-19 WO disclosed
EP-1809288-A1 USE OF 1,4-BIS (3-AMINOALKYL) PIPERAZINE DERIVATIVES IN THE TREATMENT OF NEURODEGENERATIVE DISEASES INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) 2007-07-25 EP disclosed
WO-2006051489-A1 USE OF 1,4-BIS (3-AMINOALKYL) PIPERAZINE DERIVATIVES IN THE TREATMENT OF NEURODEGENERATIVE DISEASES INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) 2006-05-18 WO disclosed