SCHEMBL3367168

SCHEMBL3367168

CC(C)(C)OC(=O)N[C@@H]1CC(=O)N(c2ccc(O)cc2)C1

nearest known ligand 0.56

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.52
TP53 P04637 3/20 0.49
POLB P06746 3/20 0.49
MAPT P10636 4/20 0.48
KDM4E B2RXH2 1/20 0.48
SMN1; SMN2 Q16637 2/20 0.47

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
SCHEMBL3367166 1.00 LMNA (0.52) LMNATP53POLBMAPTKDM4E
SCHEMBL17967299 0.90 KMT2A (0.55) LMNATP53POLBMAPTKDM4E
SCHEMBL17967267 0.90 KMT2A (0.55) LMNATP53POLBMAPTKDM4E
SCHEMBL19793290 0.90 KMT2A (0.55) LMNATP53POLBMAPTKDM4E
SCHEMBL16491302 0.89 LMNA (0.51) LMNATP53POLBMAPTKDM4E
SCHEMBL16491304 0.89 LMNA (0.51) LMNATP53POLBMAPTKDM4E
SCHEMBL16491301 0.89 LMNA (0.51) LMNATP53POLBMAPTKDM4E
SCHEMBL12841501 0.89 TP53 (0.58) LMNATP53POLBMAPTKDM4E
SCHEMBL17383722 0.88 POLB (0.61) LMNATP53POLBMAPT
SCHEMBL17967145 0.85 POLB (0.49) LMNATP53POLBMAPTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1542970-B1 PYRROLIDONE DERIVATIVES AS MAOB INHIBITORS HOFFMANN LA ROCHE (CH) 2010-06-30 EP disclosed
US-7151111-B2 4-pyrrolidino-phenyl-benzyl ether derivatives HOFFMANN-LA ROCHE INC. (US) 2006-12-19 US disclosed
EP-1542970-A1 PYRROLIDONE DERIVATIVES AS MAOB INHIBITORS F.HOFFMANN-LA ROCHE AG (CH) 2005-06-22 EP disclosed
US-20040116707-A1 4-Pyrrolidino-phenyl-benzyl ether derivatives HOFFMANN-LA ROCHE INC. 2004-06-17 US disclosed
WO-2004026825-A1 PYRROLIDONE DERIVATIVES AS MAOB INHIBITORS F.HOFFMANN-LA ROCHE AG (CH) 2004-04-01 WO disclosed