SCHEMBL5677293

SCHEMBL5677293

Cc1ccnc2[nH]c(=O)c(CC(=O)O)cc12

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 1/20 0.40
KMT2A Q03164 4/20 0.39
KDM4E B2RXH2 6/20 0.39
HSD17B10 Q99714 5/20 0.39
ALDH1A1 P00352 3/20 0.39
HPGD P15428 1/20 0.39
PTGS2 P35354 4/20 0.38
PTGS1 P23219 3/20 0.38
LMNA P02545 1/20 0.38
MAPK1 P28482 1/20 0.38
MEN1 O00255 3/20 0.38
GAA P10253 2/20 0.38
MAPT P10636 2/20 0.38
TSHR P16473 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
PIM1 P11309 1/20 0.37

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
SCHEMBL678203 0.84 DAO (0.49) EGLN1PTGS2PTGS1PIM1
SCHEMBL5677159 0.75 DAO (0.59) EGLN1KMT2AKDM4EALDH1A1HPGD
SCHEMBL23147745 0.74 NUDT1 (0.44) KDM4EHPGD
SCHEMBL29721792 0.74 NUDT1 (0.44) KDM4EHPGD
SCHEMBL31145982 0.73 GRIN2D (0.41) EGLN1KMT2AKDM4EHSD17B10ALDH1A1
SCHEMBL5681251 0.73 KDM4E (0.40) KMT2AKDM4EHSD17B10ALDH1A1HPGD
SCHEMBL5676880 0.72 KDM4E (0.43) KMT2AKDM4EHSD17B10ALDH1A1HPGD
SCHEMBL4066394 0.71 PIM1 (0.50) KMT2AKDM4EHSD17B10ALDH1A1HPGD
SCHEMBL31145797 0.70 GRIN2D (0.39) EGLN1KMT2AKDM4EHSD17B10ALDH1A1
SCHEMBL31146183 0.70 GRIN2D (0.39) EGLN1KMT2AKDM4EHSD17B10ALDH1A1

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 2 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