SCHEMBL30643102

SCHEMBL30643102

CN(C)Cc1ccc(-n2c(C(=O)N(C)C)cc3cnc(N[C@@H]4CCOC[C@H]4O)nc32)cc1

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CDK1 P06493 1/20 0.46
CDK2 P24941 1/20 0.46
CDK4 P11802 19/20 0.46
CCND1 P24385 14/20 0.46
CCND3 P30281 9/20 0.43
CDK6 Q00534 9/20 0.43

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
SCHEMBL30643141 0.90 CDK4 (0.47) CDK4CCND1CCND3CDK6
SCHEMBL30643103 0.88 CDK4 (0.44) CDK1CDK2CDK4CCND1CCND3
SCHEMBL30643116 0.88 CDK4 (0.44) CDK1CDK2CDK4CCND1CCND3
SCHEMBL30643138 0.88 CDK4 (0.42) CDK1CDK2CDK4CCND1CCND3
SCHEMBL30643125 0.86 CDK4 (0.41) CDK1CDK2CDK4CCND1CCND3
SCHEMBL30643140 0.82 CDK4 (0.42) CDK1CDK4CCND1CCND3CDK6
SCHEMBL29750280 0.82 CDK4 (0.68) CDK1CDK2CDK4CCND1CCND3
SCHEMBL30643100 0.82 CDK4 (0.42) CDK4CCND1CCND3CDK6
SCHEMBL30643118 0.81 CDK4 (0.42) CDK1CDK2CDK4CCND1CCND3
SCHEMBL30643147 0.81 CDK4 (0.40) CDK1CDK2CDK4CCND1CCND3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4519267-A1 HETEROCYCLIC COMPOUNDS, COMPOSITIONS THEREOF, AND METHODS OF TREATMENT THEREWITH BeiGene, Ltd. (KY) 2025-03-12 EP disclosed
US-20250066372-A1 HETEROCYCLIC COMPOUNDS, COMPOSITIONS THEREOF, AND METHODS OF TREATMENT THEREWITH BEIGENE, LTD. (KY) 2025-02-27 US disclosed
CN-119156389-A Heterocyclic compounds, compositions thereof and methods of treatment thereof 百济神州有限公司 2024-12-17 CN disclosed
WO-2023213271-A1 HETEROCYCLIC COMPOUNDS, COMPOSITIONS THEREOF, AND METHODS OF TREATMENT THEREWITH BEIGENE , LTD. (KY) 2023-11-09 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-20250066372-A1 HETEROCYCLIC COMPOUNDS, COMPOSITIONS THEREOF, AND METHODS OF TREATMENT THEREWITH CDK1, CDK2, CDK4 CDK1 1/4885CDK2 2/4885CDK4 3/4885

“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.