SCHEMBL25825017

SCHEMBL25825017

CC(C)(C)OC(=O)NC1CCN(C(=O)CCN2CCN(c3cccc(C4CCC(=O)NC4=O)n3)CC2)CC1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 5/20 0.42
DRD3 P35462 2/20 0.42
DDB1 Q16531 7/20 0.41
CRBN Q96SW2 7/20 0.41
KCNA3 P22001 1/20 0.41
CKS1B P61024 1/20 0.40
SKP1 P63208 1/20 0.40
SKP2 Q13309 1/20 0.40
PARP1 P09874 2/20 0.39
HTR1A P08908 1/20 0.38
DRD4 P21917 1/20 0.38
HTR2A P28223 1/20 0.38
HTR2C P28335 1/20 0.38
HTR2B P41595 1/20 0.38
SUV39H2 Q9H5I1 2/20 0.37
ACACB O00763 1/20 0.36
ACACA Q13085 1/20 0.36

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
SCHEMBL25256706 0.88 HTR7 (0.39) DRD2DRD3DDB1CRBNPARP1
SCHEMBL25825109 0.84 CRBN (0.42) DRD2DRD3DDB1CRBNKCNA3
SCHEMBL25821980 0.84 DDB1 (0.44) DRD2DRD3DDB1CRBNKCNA3
SCHEMBL30135745 0.84 DDB1 (0.44) DRD2DRD3DDB1CRBNKCNA3
SCHEMBL25819151 0.84 DDB1 (0.45) DRD2DRD3DDB1CRBNKCNA3
SCHEMBL25034990 0.81 DDB1 (0.45) DRD2DRD3DDB1CRBNKCNA3
SCHEMBL30135838 0.79 DDB1 (0.51) DRD2DRD3DDB1CRBNKCNA3
SCHEMBL24670630 0.79 DDB1 (0.49) DDB1CRBN
SCHEMBL26839309 0.79 CRBN (0.55) DRD2DRD3DDB1CRBNKCNA3
SCHEMBL30135962 0.79 DDB1 (0.46) DRD2DRD3DDB1CRBNKCNA3

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 7 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-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 DRD2 4476/4885DRD3 4499/4885DDB1 132/4885
US-11912710-B2 Substituted pyrimido[4,5-b][1,4]diazepines as PLK1 degradation inducers PLK1, BUB1B, BUB1 DRD2 3814/4885DRD3 3937/4885DDB1 77/4885

“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.