SCHEMBL25824644

SCHEMBL25824644

COc1ccc(N2CCN(CCC(=O)N3CCC(NC(=O)OC(C)(C)C)CC3)CC2)cc1N1CCC(=O)NC1=O

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DDB1 Q16531 2/20 0.42
CRBN Q96SW2 2/20 0.42
HTR7 P34969 1/20 0.41
DRD2 P14416 11/20 0.41
DRD3 P35462 2/20 0.40
KCNA3 P22001 1/20 0.39
SUV39H2 Q9H5I1 2/20 0.38
DRD4 P21917 2/20 0.38
CFTR P13569 1/20 0.38
ALOX15 P16050 1/20 0.37

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 0.94 DDB1 (0.42) DDB1CRBNHTR7DRD2DRD3
SCHEMBL25035205 0.89 KCNA3 (0.44) DDB1CRBNHTR7DRD2DRD3
SCHEMBL30475475 0.85 HTR7 (0.44) DDB1CRBNHTR7DRD2ALOX15
SCHEMBL25034750 0.85 HTR7 (0.44) DDB1CRBNHTR7DRD2ALOX15
SCHEMBL25300532 0.84 HTR7 (0.42) DDB1CRBNHTR7DRD2DRD3
SCHEMBL30135802 0.83 PDE3B (0.41) DDB1CRBNDRD2DRD3SUV39H2
SCHEMBL25035187 0.83 PDE3B (0.41) DDB1CRBNDRD2DRD3SUV39H2
SCHEMBL25033930 0.79 HTR7 (0.42) DDB1CRBNHTR7DRD2DRD3
SCHEMBL25819151 0.79 DDB1 (0.45) DDB1CRBNHTR7DRD2DRD3
SCHEMBL25033928 0.78 PDE3B (0.41) DDB1CRBNDRD2DRD3SUV39H2

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 DDB1 132/4885CRBN 2136/4885HTR7 4012/4885
US-11912710-B2 Substituted pyrimido[4,5-b][1,4]diazepines as PLK1 degradation inducers PLK1, BUB1B, BUB1 DDB1 77/4885CRBN 2496/4885HTR7 2918/4885

“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.