SCHEMBL25035204

SCHEMBL25035204

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

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 9/20 0.50
HTR1A P08908 8/20 0.50
DDB1 Q16531 2/20 0.46
CRBN Q96SW2 2/20 0.46
ADAMTS5 Q9UNA0 3/20 0.41
ALDH1A1 P00352 1/20 0.40
ADAMTS4 O75173 1/20 0.40

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
SCHEMBL25301724 0.86 HTR7 (0.49) HTR7HTR1ADDB1CRBNADAMTS5
SCHEMBL25034750 0.85 HTR7 (0.44) HTR7HTR1ADDB1CRBNADAMTS5
SCHEMBL25033930 0.85 HTR7 (0.42) HTR7HTR1ADDB1CRBNADAMTS5
SCHEMBL30475475 0.85 HTR7 (0.44) HTR7HTR1ADDB1CRBNADAMTS5
SCHEMBL25031287 0.84 HTR7 (0.46) HTR7HTR1ADDB1CRBNADAMTS5
SCHEMBL29179852 0.82 DDB1 (0.57) HTR7HTR1ADDB1CRBNADAMTS5
SCHEMBL22119568 0.81 CRBN (0.64) DDB1CRBNALDH1A1
SCHEMBL25818079 0.81 DDB1 (0.50) HTR7HTR1ADDB1CRBNALDH1A1
SCHEMBL25035205 0.80 KCNA3 (0.44) HTR7HTR1ADDB1CRBN
SCHEMBL29179871 0.80 CRBN (0.52) HTR7HTR1ADDB1CRBN

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
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
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 HTR7 4012/4885HTR1A 4156/4885DDB1 132/4885
US-11912710-B2 Substituted pyrimido[4,5-b][1,4]diazepines as PLK1 degradation inducers PLK1, BUB1B, BUB1 HTR7 2918/4885HTR1A 2866/4885DDB1 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.