SCHEMBL5492918

SCHEMBL5492918

CN1C2CC(=O)CC1CN(C(=O)O)C2

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.50
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
MAPT P10636 1/20 0.35
POLB P06746 2/20 0.32
BRD4 O60885 1/20 0.31
ACE P12821 1/20 0.30

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
SCHEMBL13451563 0.79 LMNA (0.41) MAPK1MEN1KMT2A
SCHEMBL737422 0.77 NR1H2 (0.46) MAPK1MEN1KMT2AMAPT
SCHEMBL6952003 0.76 MAPK1 (0.60) MAPK1MEN1KMT2ABRD4
SCHEMBL19708949 0.75 HTR3A (0.33)
SCHEMBL21821171 0.74 CHRNB2 (0.32) MAPTPOLB
SCHEMBL3398592 0.74 CHRNB2 (0.32) MAPTPOLB
SCHEMBL2745077 0.74 CHRNB2 (0.32) MAPTPOLB
Carbamic Acid SCHEMBL12615819 0.73 MAPK1 (0.63) MAPK1MEN1KMT2A
SCHEMBL6956473 0.71 MAPK1 (0.54) MAPK1MEN1KMT2AMAPT
SCHEMBL3384724 0.71 CHRNB2 (0.36)

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-1786814-A1 BICYCLONONENE DERIVATIVES AS RENIN INHIBITORS Actelion Pharmaceuticals Ltd. (CH) 2007-05-23 EP disclosed
WO-2006131884-A2 THIAZOLE SUBSTITUTED DIAZABICYCLONONANE OR-NONENE DERIVATIVES AS RENIN INHIBITORS ACTELION PHARMACEUTICALS LTD (CH) 2006-12-14 WO disclosed
WO-2006021402-A1 BICYCLONONENE DERIVATIVES AS RENIN INHIBITORS ACTELION PHARMACEUTICALS LTD. (CH) 2006-03-02 WO disclosed