SCHEMBL25819561

SCHEMBL25819561

CC(C)(C)OC(=O)NC1CCN(C(=O)CCN2CCN(c3cnn(C4CCC(=O)NC4=O)c3)CC2)CC1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 10/20 0.42
DDB1 Q16531 9/20 0.42
KCNA3 P22001 1/20 0.38
DRD2 P14416 5/20 0.38
DRD3 P35462 2/20 0.38
NPC1L1 Q9UHC9 2/20 0.37
CCNC P24863 1/20 0.37
CDK8 P49336 1/20 0.37
IRAK1 P51617 1/20 0.37
NTRK3 Q16288 1/20 0.37
HASPIN Q8TF76 1/20 0.37
CDK19 Q9BWU1 1/20 0.37
IRAK4 Q9NWZ3 1/20 0.37
IRAK3 Q9Y616 1/20 0.37
MET P08581 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
SCHEMBL25035120 0.83 HTR7 (0.39) CRBNDDB1CCNCCDK8IRAK1
SCHEMBL26839717 0.81 CRBN (0.53) CRBNDDB1CCNCCDK8IRAK1
SCHEMBL25819151 0.81 DDB1 (0.45) CRBNDDB1KCNA3DRD2DRD3
SCHEMBL25024452 0.81 DDB1 (0.51) CRBNDDB1KCNA3DRD2DRD3
SCHEMBL30135945 0.80 ESR1 (0.45) CRBNDDB1CCNCCDK8IRAK1
SCHEMBL30135896 0.79 CRBN (0.43) CRBNDDB1KCNA3DRD2DRD3
SCHEMBL30135743 0.79 CRBN (0.45) CRBNDDB1KCNA3DRD2DRD3
SCHEMBL25035205 0.79 KCNA3 (0.44) CRBNDDB1KCNA3DRD2DRD3
SCHEMBL25825109 0.79 CRBN (0.42) CRBNDDB1KCNA3DRD2DRD3
SCHEMBL30289129 0.79 CRBN (0.45) CRBNDDB1KCNA3DRD2DRD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11912710-B2 Substituted pyrimido[4,5-b][1,4]diazepines as PLK1 degradation inducers UPPTHERA, INC. (KR) 2024-02-27 US disclosed
US-11912710-B2 Substituted pyrimido[4,5-b][1,4]diazepines as PLK1 degradation inducers UPPTHERA, INC. (KR) 2024-02-27 US disclosed
US-11912710-B2 Substituted pyrimido[4,5-b][1,4]diazepines as PLK1 degradation inducers UPPTHERA, INC. (KR) 2024-02-27 US disclosed
US-20230219966-A1 NOVEL PLK1 DEGRADATION INDUCING COMPOUND UPPTHERA, INC. (KR) 2023-07-13 US disclosed
US-20230219966-A1 NOVEL PLK1 DEGRADATION INDUCING COMPOUND UPPTHERA, INC. (KR) 2023-07-13 US disclosed
US-20230219966-A1 NOVEL PLK1 DEGRADATION INDUCING COMPOUND UPPTHERA, INC. (KR) 2023-07-13 US disclosed
EP-4157849-A1 NOVEL PLK1 DEGRADATION INDUCING COMPOUND Uppthera, Inc. (KR) 2023-04-05 EP disclosed
WO-2023017446-A1 NOVEL PLK1 DEGRADATION INDUCING COMPOUND UPPTHERA, INC. (KR) 2023-02-16 WO disclosed
WO-2023018238-A1 NOVEL PLK1 DEGRADATION INDUCING COMPOUND UPPTHERA, INC. (KR) 2023-02-16 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20230219966-A1 NOVEL PLK1 DEGRADATION INDUCING COMPOUND PLK1, BUB1B, BUB1 CRBN 2136/4885DDB1 132/4885KCNA3 4550/4885
US-11912710-B2 Substituted pyrimido[4,5-b][1,4]diazepines as PLK1 degradation inducers PLK1, BUB1B, BUB1 CRBN 2496/4885DDB1 77/4885KCNA3 4041/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.