SCHEMBL25035458

SCHEMBL25035458

CCOC(=O)Cc1cnc(N2CCC3(CC2)CN(C(=O)OC(C)(C)C)C3)nc1

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 8/20 0.45
CYP11B2 P19099 1/20 0.43
ACACB O00763 3/20 0.43
PIK3R1 P27986 3/20 0.41
PIK3CA P42336 3/20 0.41
MAPT P10636 1/20 0.40
RET P07949 3/20 0.39
TSHR P16473 1/20 0.39
HSD17B10 Q99714 1/20 0.39

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
SCHEMBL32679621 0.85 ACACB (0.46) GPR119CYP11B2ACACBMAPTTSHR
SCHEMBL30135848 0.85 LMNA (0.39) GPR119PIK3R1PIK3CATSHRHSD17B10
SCHEMBL28614518 0.80 CYP11B2 (0.51) GPR119CYP11B2ACACBMAPT
SCHEMBL22720703 0.80 CYP11B2 (0.49) GPR119CYP11B2ACACBMAPTRET
SCHEMBL12723192 0.78 CYP3A4 (0.48) GPR119CYP11B2ACACBMAPT
SCHEMBL29058892 0.76 CYP11B2 (0.42) GPR119CYP11B2ACACBRET
SCHEMBL22720835 0.75 GPR119 (0.50) GPR119CYP11B2ACACBMAPTTSHR
SCHEMBL23742297 0.75 CYP11B2 (0.56) GPR119CYP11B2ACACBPIK3R1PIK3CA
SCHEMBL25819551 0.73 L3MBTL1 (0.35) ACACBPIK3R1PIK3CA
SCHEMBL484867 0.73 CYP11B2 (0.54) GPR119CYP11B2ACACBMAPTTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116322700-B Novel PLK1 degradation inducing compounds 厄普特拉株式会社 2024-08-20 CN 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
CN-116322700-A Novel PLK1 degradation inducing compounds 厄普特拉株式会社 2023-06-23 CN 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

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

For each of this compound's patents that has machine-readable text (1 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-11912710-B2 Substituted pyrimido[4,5-b][1,4]diazepines as PLK1 degradation inducers PLK1, BUB1B, BUB1 GPR119 4626/4885CYP11B2 2597/4885ACACB 2427/4885

“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.