SCHEMBL25033944

SCHEMBL25033944

C[C@H](CN1CCN(c2ccc(C3CCC(=O)NC3=O)cc2F)CC1)C1CCN(N)CC1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.41
CRBN Q96SW2 18/20 0.40
DDB1 Q16531 16/20 0.40
IKZF3 Q9UKT9 5/20 0.38
DRD2 P14416 2/20 0.36
ADRA1D P25100 1/20 0.36
ADRA1A P35348 1/20 0.36
ADRA1B P35368 1/20 0.36
HTR1A P08908 1/20 0.35
HTR7 P34969 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
SCHEMBL25033888 1.00 POLB (0.41) POLBCRBNDDB1IKZF3DRD2
SCHEMBL25033883 0.91 POLB (0.41) POLBCRBNDDB1IKZF3DRD2
SCHEMBL25033942 0.91 POLB (0.41) POLBCRBNDDB1IKZF3DRD2
SCHEMBL25033945 0.90 CRBN (0.41) POLBCRBNDDB1IKZF3DRD2
SCHEMBL25033890 0.90 CRBN (0.41) POLBCRBNDDB1IKZF3DRD2
SCHEMBL25033943 0.86 DDB1 (0.53) CRBNDDB1
SCHEMBL25033886 0.86 DDB1 (0.53) CRBNDDB1
SCHEMBL30981016 0.85 POLB (0.48) POLBCRBNDDB1
SCHEMBL30981090 0.85 POLB (0.48) POLBCRBNDDB1
SCHEMBL30981259 0.85 POLB (0.48) POLBCRBNDDB1

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-2023018238-A1 NOVEL PLK1 DEGRADATION INDUCING COMPOUND UPPTHERA, INC. (KR) 2023-02-16 WO disclosed
WO-2023017446-A1 NOVEL PLK1 DEGRADATION INDUCING COMPOUND UPPTHERA, INC. (KR) 2023-02-16 WO disclosed