SCHEMBL5679231

SCHEMBL5679231

CC(C(=O)O)C1=NNC(=O)CC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.39
NPC1 O15118 3/20 0.39
SMN1; SMN2 Q16637 4/20 0.39
LMNA P02545 4/20 0.39
MAPT P10636 4/20 0.33
PDE3B Q13370 1/20 0.33
PDE3A Q14432 1/20 0.33
KMT2A Q03164 1/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
KDM4E B2RXH2 1/20 0.33
SMYD3 Q9H7B4 1/20 0.32
PTGS1 P23219 1/20 0.32
PTGS2 P35354 1/20 0.32
POLB P06746 2/20 0.32
ALDH1A1 P00352 1/20 0.32
MAPK1 P28482 1/20 0.32
PDE5A O76074 1/20 0.31
PDE4B Q07343 1/20 0.31
GAA P10253 2/20 0.31
MME P08473 1/20 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
SCHEMBL3165004 0.66 SMN1; SMN2 (0.51) RAB9ANPC1SMN1; SMN2LMNAMAPT
Succinimide SCHEMBL27427653 0.65 CRBN (0.55) LMNAMAPTKMT2AKDM4EPTGS1
SCHEMBL13938473 0.64 NPC1 (0.46) RAB9ANPC1SMN1; SMN2LMNAMAPT
SCHEMBL27040200 0.62 SMN1; SMN2 (0.39) RAB9ANPC1SMN1; SMN2MAPTPDE3B
SCHEMBL338764 0.62 SMN1; SMN2 (0.39) RAB9ANPC1SMN1; SMN2LMNAMAPT
SCHEMBL10333185 0.61
SCHEMBL5201218 0.60 SMYD3 (0.44) RAB9ANPC1SMN1; SMN2LMNAMAPT
SCHEMBL97281 0.58
SCHEMBL10916141 0.57 PTGS1 (0.40) LMNAKMT2APTGS1PTGS2
Succinimide SCHEMBL30804677 0.56 CRBN (0.65) NPC1LMNAMAPTKDM4EALDH1A1

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-0988045-B1 PEPTIDE NUCLEIC ACID MONOMERS AND OLIGOMERS NIELSEN PETER EIGIL (DK) 2006-02-08 EP disclosed
US-6632919-B1 Bind Watson-Crick base pairs in a double helix; specific for thymidine Nielsen, Peter (DK) 2003-10-14 US disclosed
EP-0988045-A4 PEPTIDE NUCLEIC ACID MONOMERS AND OLIGOMERS NIELSEN PETER EIGIL (DK) 2002-07-24 EP disclosed
EP-0988045-A1 PEPTIDE NUCLEIC ACID MONOMERS AND OLIGOMERS NIELSEN, Peter Eigil (DK) 2000-03-29 EP disclosed
WO-1998052595-A1 PEPTIDE NUCLEIC ACID MONOMERS AND OLIGOMERS ISIS PHARMACEUTICALS, INC. (US) 1998-11-26 WO disclosed