SCHEMBL29965130

SCHEMBL29965130

Cn1nc(Br)c2ncn(CC(=O)O)c(=O)c21

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CSNK2A2 P19784 3/20 0.51
CSNK2A1 P68400 3/20 0.51
LMNA P02545 1/20 0.50
ADORA2B P29275 3/20 0.47
HDAC6 Q9UBN7 3/20 0.42
KDM4E B2RXH2 3/20 0.38
ALDH1A1 P00352 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
POLB P06746 2/20 0.35
PTGS2 P35354 1/20 0.35
PDE4A P27815 2/20 0.34
PDE4B Q07343 2/20 0.34
PDE4C Q08493 2/20 0.34
PDE4D Q08499 2/20 0.34
ADORA2A P29274 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34

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
SCHEMBL18742219 0.84 LMNA (0.51) CSNK2A2CSNK2A1LMNAADORA2BHDAC6
Hydrochloric Acid SCHEMBL18742227 0.83 LMNA (0.50) CSNK2A2CSNK2A1LMNAADORA2BHDAC6
SCHEMBL24750355 0.82 F2 (0.38) CSNK2A2CSNK2A1LMNAHDAC6KDM4E
SCHEMBL24750385 0.72 POLB (0.50) TDP1POLB
SCHEMBL24750405 0.72 LMNA (0.43) LMNA
SCHEMBL29966497 0.72 LMNA (0.43) LMNA
SCHEMBL18704122 0.72 ADORA2B (0.52) CSNK2A2CSNK2A1LMNAADORA2BHDAC6
SCHEMBL18704235 0.71 ADORA2B (0.49) CSNK2A2CSNK2A1LMNAADORA2BHDAC6
SCHEMBL24750113 0.71 BRD4 (0.42) LMNAADORA2B
Hydrochloric Acid SCHEMBL18742217 0.71 ADORA2B (0.51) CSNK2A2CSNK2A1LMNAADORA2BHDAC6

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-4313988-A1 PYRAZOLOPYRIMIDINONE COMPOUNDS Orphagen Pharmaceuticals, Inc. (US) 2024-02-07 EP disclosed
WO-2022204481-A1 PYRAZOLOPYRIMIDINONE COMPOUNDS Orphagen Pharmaceuticals, Inc. (US) 2022-09-29 WO disclosed