SCHEMBL25035205

SCHEMBL25035205

CC(C)(C)OC(=O)NC1CCN(C(=O)CCN2CCN(c3ccc(N4CCC(=O)NC4=O)cc3)CC2)CC1

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KCNA3 P22001 1/20 0.44
DRD2 P14416 6/20 0.43
DDB1 Q16531 5/20 0.43
CRBN Q96SW2 5/20 0.43
DRD3 P35462 2/20 0.43
HTR7 P34969 6/20 0.41
HTR1A P08908 4/20 0.41
NPC1L1 Q9UHC9 1/20 0.39
SIGMAR1 Q99720 1/20 0.38

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
SCHEMBL25033926 0.89 DDB1 (0.42) KCNA3DRD2DDB1CRBNDRD3
SCHEMBL25824644 0.89 DDB1 (0.42) KCNA3DRD2DDB1CRBNDRD3
SCHEMBL25819151 0.87 DDB1 (0.45) KCNA3DRD2DDB1CRBNDRD3
SCHEMBL30136072 0.86 TSHR (0.41) DRD2DDB1CRBNHTR7HTR1A
SCHEMBL25301724 0.86 HTR7 (0.49) DRD2DDB1CRBNDRD3HTR7
SCHEMBL25024452 0.86 DDB1 (0.51) KCNA3DRD2DDB1CRBNDRD3
SCHEMBL30289278 0.85 DRD2 (0.57) DRD2DDB1CRBNDRD3
SCHEMBL23173823 0.85 DRD2 (0.57) DRD2DDB1CRBNDRD3
SCHEMBL30135743 0.85 CRBN (0.45) KCNA3DRD2DDB1CRBNDRD3
SCHEMBL30289344 0.82 DDB1 (0.46) KCNA3DRD2DDB1CRBNDRD3

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 11 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-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
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 KCNA3 4550/4885DRD2 4476/4885DDB1 132/4885
US-11912710-B2 Substituted pyrimido[4,5-b][1,4]diazepines as PLK1 degradation inducers PLK1, BUB1B, BUB1 KCNA3 4041/4885DRD2 3814/4885DDB1 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.