SCHEMBL5678973

SCHEMBL5678973

CC(C)(C)C(=O)Nc1nc2ccccc2cc1C=O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.49
KDM4E B2RXH2 4/20 0.49
L3MBTL1 Q9Y468 2/20 0.49
GAA P10253 1/20 0.45
ADORA1 P30542 2/20 0.43
LMNA P02545 4/20 0.40
SMN1; SMN2 Q16637 4/20 0.40
HTT P42858 3/20 0.40
TP53 P04637 3/20 0.40
CYP1A2 P05177 2/20 0.40
CYP2C9 P11712 2/20 0.40
CYP2C19 P33261 2/20 0.40
HPGD P15428 2/20 0.40
POLB P06746 2/20 0.38
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
CYP3A4 P08684 1/20 0.38
MAPT P10636 4/20 0.38

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
SCHEMBL15565974 0.80 CETP (0.47) ALDH1A1KDM4EL3MBTL1ADORA1LMNA
SCHEMBL123585 0.77 L3MBTL1 (0.42) ALDH1A1L3MBTL1ADORA1LMNASMN1; SMN2
SCHEMBL29951599 0.75 L3MBTL1 (0.41) ALDH1A1KDM4EL3MBTL1ADORA1LMNA
SCHEMBL247107 0.75 L3MBTL1 (0.41) ALDH1A1KDM4EL3MBTL1ADORA1LMNA
SCHEMBL29950915 0.75 L3MBTL1 (0.41) ALDH1A1KDM4EL3MBTL1ADORA1LMNA
SCHEMBL2209190 0.75 L3MBTL1 (0.41) ALDH1A1KDM4EL3MBTL1ADORA1LMNA
SCHEMBL14984329 0.75 BRD4 (0.43) ALDH1A1KDM4EL3MBTL1ADORA1LMNA
SCHEMBL123133 0.74 L3MBTL1 (0.36) ALDH1A1KDM4EL3MBTL1GAAADORA1
SCHEMBL16790819 0.73 L3MBTL1 (0.39) ALDH1A1KDM4EL3MBTL1ADORA1LMNA
SCHEMBL5126193 0.73 ADORA1 (0.47) ALDH1A1KDM4EADORA1LMNASMN1; 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 6 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
US-6617422-B1 Of given formula; stronger binding and greater specificity than oligonucleotides; useful as probes in cloning, blotting procedures, and in applications such as fluorescence in situ hybridization; can use to detect point mutations Nielsen, Peter (DK) 2003-09-09 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