SCHEMBL6329965

SCHEMBL6329965

CC(C)[Si](OCCCc1cccc2c(C3=C(c4cn5c6c(cccc46)C(C)(C)CC5)C(=O)NC3=O)c[nH]c12)(C(C)C)C(C)C

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CDK4 P11802 6/20 0.35
CCND1 P24385 4/20 0.35
GSK3B P49841 12/20 0.35
PRKCB P05771 4/20 0.35
CDK2 P24941 2/20 0.35
PDK1 Q15118 1/20 0.35
GSK3A P49840 8/20 0.34
PRKACA P17612 3/20 0.33
PRKACG P22612 3/20 0.33
PRKACB P22694 3/20 0.33
PRKCA P17252 2/20 0.32
PRKCH P24723 2/20 0.32
PRKCE Q02156 2/20 0.32
PRKCQ Q04759 2/20 0.32
PRKCD Q05655 2/20 0.32
CAMK2B Q13554 1/20 0.32
CAMK2G Q13555 1/20 0.32
CAMK2D Q13557 1/20 0.32
CAMK2A Q9UQM7 1/20 0.32

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
SCHEMBL6327758 0.92 CDK4 (0.35) CDK4CCND1GSK3BPRKCBCDK2
SCHEMBL6325776 0.85 CDK4 (0.40) CDK4CCND1GSK3BPRKCBCDK2
SCHEMBL6327413 0.81 GSK3B (0.48) CDK4GSK3BPRKCBCDK2PDK1
SCHEMBL6336036 0.81 CDK4 (0.35) CDK4CCND1GSK3BPRKCBCDK2
SCHEMBL6325835 0.76 CDK4 (0.44) CDK4CCND1GSK3BPRKCBCDK2
SCHEMBL6327991 0.75 CDK4 (0.55) CDK4CCND1GSK3BPRKCBCDK2
SCHEMBL6327416 0.73 GSK3B (0.33) CDK4CCND1GSK3BPRKCBCDK2
SCHEMBL6328457 0.72 CDK4 (0.46) CDK4CCND1GSK3BPRKCBCDK2
SCHEMBL6326123 0.72 GSK3B (0.51) CDK4GSK3BPRKCBCDK2PDK1
SCHEMBL6334229 0.70 CDK4 (0.59) CDK4CCND1GSK3BPRKCBCDK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6867198-B2 Agents and methods for the treatment of proliferative diseases ELI LILLY AND COMPANY (US) 2005-03-15 US disclosed
US-20030229026-A1 Agents and methods for the treatment of proliferative diseases ELI LILLY AND COMPANY 2003-12-11 US 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-20030229026-A1 Agents and methods for the treatment of proliferative diseases MKI67, CDKN1A, CDK1 CDK4 5/4885CCND1 70/4885GSK3B 668/4885

“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.