SCHEMBL30834142

SCHEMBL30834142

Cn1nccc1C1CCCN(c2ncnc3c2CCC3)C1

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PDE3A Q14432 1/20 0.36
MAP4K4 O95819 1/20 0.36
PRKDC P78527 3/20 0.35
JAK3 P52333 1/20 0.34
BTK Q06187 2/20 0.34
KHK P50053 1/20 0.34
LRRK2 Q5S007 6/20 0.33
ATR Q13535 2/20 0.33
ATRIP Q8WXE1 2/20 0.33
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
DOT1L Q8TEK3 1/20 0.33
MAPT P10636 1/20 0.33
RECQL P46063 1/20 0.33
GRM4 Q14833 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33

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
SCHEMBL27201526 0.84 HRH4 (0.52) MAP4K4
SCHEMBL23764721 0.70 JAK3 (0.49) PRKDCJAK3LRRK2ATRATRIP
SCHEMBL19723894 0.68 HCAR2 (0.42)
SCHEMBL18843937 0.66 HCAR2 (0.41)
SCHEMBL19723890 0.66 HCAR2 (0.41)
SCHEMBL12539281 0.66 PDE2A (0.46) PDE3ARECQL
SCHEMBL26957501 0.66 GAA (0.40)
SCHEMBL14346645 0.65 HRH3 (0.50) NPSR1
SCHEMBL12802841 0.64
SCHEMBL31217522 0.63 MAPT (0.59) MAPTNPSR1

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
WO-2024073502-A1 HETEROCYCLIC COMPOUNDS AS E3 LIGASE INHIBITORS ACCUTAR BIOTECHNOLOGY INC. (US) 2024-04-04 WO claimed
WO-2024073502-A1 HETEROCYCLIC COMPOUNDS AS E3 LIGASE INHIBITORS ACCUTAR BIOTECHNOLOGY INC. (US) 2024-04-04 WO disclosed