SCHEMBL25565979

SCHEMBL25565979

CCCN(CC)C[C@H]1CCN(C)C1

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NCF1 P14598 1/20 0.36
PGR P06401 3/20 0.34
DRD2 P14416 2/20 0.33
DRD3 P35462 2/20 0.33
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
BCHE P06276 1/20 0.31
CYP1A2 P05177 1/20 0.30
CYP2D6 P10635 1/20 0.30

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
SCHEMBL25565977 1.00 NCF1 (0.36) NCF1PGRDRD2DRD3MEN1
SCHEMBL25565978 1.00 NCF1 (0.36) NCF1PGRDRD2DRD3MEN1
SCHEMBL25565975 0.91 NCF1 (0.42) NCF1PGRDRD2DRD3
SCHEMBL15473865 0.88 NCF1 (0.41) NCF1PGRMEN1KMT2ACYP1A2
SCHEMBL13006566 0.79 MEN1 (0.40) NCF1DRD3MEN1KMT2ACYP2D6
SCHEMBL13361145 0.78 NCF1 (0.48) NCF1
SCHEMBL25565980 0.78 NCF1 (0.41) NCF1PGRDRD2DRD3BCHE
SCHEMBL10035081 0.78 DRD2 (0.40) DRD2DRD3CYP1A2CYP2D6
SCHEMBL27397553 0.76 GNAO1 (0.42) NCF1PGRDRD2DRD3
SCHEMBL23841454 0.75 NCF1 (0.45) NCF1CYP1A2CYP2D6

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023083194-A1 WEE1 PROTEIN KINASE DEGRADATION AGENT AND USE THEREOF 杭州格博生物医药有限公司 2023-05-19 WO disclosed