SCHEMBL4769948

SCHEMBL4769948

CCOCCCNc1nc(Cl)ncc1C(=O)NC(C)(C)C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
STK17B O94768 1/20 0.46
STK17A Q9UEE5 1/20 0.46
LMNA P02545 1/20 0.39
JAK3 P52333 1/20 0.39
ALDH1A1 P00352 1/20 0.38
KDM4E B2RXH2 1/20 0.37
NSD2 O96028 1/20 0.37
HSP90AA1 P07900 1/20 0.37
MAPT P10636 1/20 0.37
MAPK1 P28482 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
TYRO3 Q06418 1/20 0.36
MERTK Q12866 1/20 0.36
GAS6 Q14393 1/20 0.36
HPGD P15428 4/20 0.36
HTT P42858 1/20 0.36
GBA1 P04062 1/20 0.35
REN P00797 2/20 0.35

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
SCHEMBL4765257 0.87 STK17B (0.47) STK17BSTK17AJAK3KDM4ENPSR1
SCHEMBL4768852 0.85 ALDH1A1 (0.46) STK17BSTK17AJAK3ALDH1A1HPGD
SCHEMBL4774497 0.82 NFKB1 (0.40) STK17BSTK17AALDH1A1LRRK2JUN
SCHEMBL4765932 0.81 STK17B (0.43) STK17BSTK17AALDH1A1LRRK2JUN
SCHEMBL4769101 0.81 STK17B (0.43) STK17BSTK17ALMNAJAK3ALDH1A1
SCHEMBL4769049 0.80 L3MBTL1 (0.48) STK17BSTK17ALMNAALDH1A1KDM4E
SCHEMBL4763606 0.79 STK17B (0.41) STK17BSTK17AKDM4EL3MBTL1LRRK2
SCHEMBL4770559 0.77 JAK2 (0.43) JAK3TYRO3MERTK
SCHEMBL4772216 0.76 STK17B (0.40) STK17BSTK17AALDH1A1HTTLRRK2
SCHEMBL4772853 0.76 TRPA1 (0.41) STK17BSTK17AJAK3LRRK2JUN

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-1303496-B9 PYRIMIDINE DERIVATIVES ASTRAZENECA AB (SE) 2008-03-19 EP disclosed
EP-1303496-B1 PYRIMIDINE DERIVATIVES ASTRAZENECA AB (SE) 2007-09-12 EP disclosed
US-6908920-B2 Pyrimidine derivatives ASTRAZENECA AB (SE) 2005-06-21 US disclosed