SCHEMBL30718696

SCHEMBL30718696

Brc1ccc2nc(C3CCNCC3)ccc2c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 1/20 0.45
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
CDC7 O00311 1/20 0.41
PIM1 P11309 1/20 0.41
CSNK2B P67870 1/20 0.41
CSNK2A1 P68400 1/20 0.41
HRH4 Q9H3N8 1/20 0.41
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
POLB P06746 1/20 0.39
KCNH2 Q12809 1/20 0.37
HRH3 Q9Y5N1 1/20 0.37
TLR9 Q9NR96 1/20 0.36
TLR8 Q9NR97 1/20 0.36
TLR7 Q9NYK1 1/20 0.36
IDO1 P14902 1/20 0.35
HTT P42858 1/20 0.35
SLC6A4 P31645 1/20 0.35
NCF1 P14598 1/20 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
SCHEMBL27146850 1.00 BACE1 (0.45) BACE1MEN1KMT2ACDC7PIM1
SCHEMBL19411398 0.89 BACE1 (0.43) BACE1MEN1KMT2ACDC7PIM1
SCHEMBL27150635 0.89 BACE1 (0.52) BACE1MEN1KMT2APOLBKCNH2
SCHEMBL30718832 0.89 BACE1 (0.52) BACE1MEN1KMT2APOLBKCNH2
SCHEMBL27108966 0.81 BACE1 (0.45) BACE1POLBKCNH2HRH3IDO1
SCHEMBL31413431 0.81 BACE1 (0.45) BACE1POLBKCNH2HRH3IDO1
SCHEMBL7954797 0.78 TLR9 (0.44) MEN1KMT2AHRH4NPC1RAB9A
SCHEMBL21000902 0.77 MEN1 (0.57) MEN1KMT2AHRH4NPC1RAB9A
SCHEMBL29733200 0.77 MEN1 (0.57) MEN1KMT2AHRH4NPC1RAB9A
SCHEMBL8359684 0.76 HPGDS (0.46) CDC7PIM1CSNK2BCSNK2A1HRH4

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-4547658-A1 WEE1 DEGRADING COMPOUNDS AND USES THEREOF Bristol-Myers Squibb Company (US) 2025-05-07 EP disclosed
CN-119325469-A WEE1 degrading compounds and uses thereof 百时美施贵宝公司 2025-01-17 CN disclosed
WO-2024006881-A1 WEE1 DEGRADING COMPOUNDS AND USES THEREOF BRISTOL-MYERS SQUIBB COMPANY (US) 2024-01-04 WO disclosed