SCHEMBL8595170

SCHEMBL8595170

CN1C(=O)[N+](C)C(=O)c2[nH]cnc21

nearest known ligand 0.34

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 3/20 0.34
ADORA2B P29275 3/20 0.34
MEN1 O00255 1/20 0.33
BLM P54132 1/20 0.33
KMT2A Q03164 1/20 0.33
ATAD2 Q6PL18 1/20 0.32
ADORA3 P0DMS8 2/20 0.31
PDE4A P27815 2/20 0.31
PDE4B Q07343 2/20 0.31
PDE4C Q08493 2/20 0.31
PDE4D Q08499 2/20 0.31
ALDH1A1 P00352 1/20 0.31
PIK3CD O00329 1/20 0.31
ALPL P05186 1/20 0.31
TMIGD3 P0DMS9 1/20 0.31
ADORA1 P30542 1/20 0.31
CYP2C19 P33261 1/20 0.31
HIF1A Q16665 1/20 0.31
BRD4 O60885 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
SCHEMBL2142794 0.69 MEN1 (0.34) ADORA2AADORA2BMEN1BLMKMT2A
SCHEMBL17210366 0.68 MEN1 (0.33) ADORA2AADORA2BMEN1BLMKMT2A
SCHEMBL20656217 0.68 MEN1 (0.33) ADORA2AADORA2BMEN1BLMKMT2A
SCHEMBL9881673 0.66 BRPF1 (0.37) MEN1BLMKMT2AATAD2ALDH1A1
SCHEMBL4434457 0.62 MEN1 (0.38) ADORA2AADORA2BMEN1BLMKMT2A
SCHEMBL31685332 0.62 MEN1 (0.34) ADORA2AADORA2BMEN1BLMKMT2A
SCHEMBL9018625 0.62 ALDH1A1 (0.32) MEN1BLMKMT2AATAD2PDE4A
SCHEMBL6674432 0.61 GDA (0.38) ADORA2AADORA2BMEN1BLMKMT2A
SCHEMBL31685548 0.60 MEN1 (0.36) ADORA2AADORA2BMEN1BLMKMT2A
SCHEMBL9881675 0.59 CRBN (0.42) MEN1KMT2AATAD2

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-0679634-B1 Method for producing a 3-oxo-propionic acid amide compound and substituted acetyl compound used therein FUJI PHOTO FILM CO LTD (JP) 1998-01-07 EP disclosed
EP-0679634-A2 Method for producing a 3-oxo-propionic acid amide compound and substituted acetyl compound used therein FUJI PHOTO FILM CO., LTD. (JP) 1995-11-02 EP disclosed