SCHEMBL6328003

SCHEMBL6328003

CC(C)[Si](OCCCc1ccc2c(C3=C(c4cn5c6c(cccc46)CN(C(=O)OC(C)(C)C)CC5)C(=O)NC3=O)c[nH]c2c1)(C(C)C)C(C)C

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 18/20 0.49
CDK4 P11802 5/20 0.49
PRKCB P05771 3/20 0.49
CDK2 P24941 3/20 0.49
PDK1 Q15118 2/20 0.49
GSK3A P49840 16/20 0.46
CAMK2B Q13554 1/20 0.44
CAMK2G Q13555 1/20 0.44
CAMK2D Q13557 1/20 0.44
CAMK2A Q9UQM7 1/20 0.44
TGFBR2 P37173 1/20 0.41
CCND1 P24385 2/20 0.41

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
SCHEMBL6327413 0.88 GSK3B (0.48) GSK3BCDK4PRKCBCDK2PDK1
SCHEMBL6328457 0.85 CDK4 (0.46) GSK3BCDK4PRKCBCDK2PDK1
SCHEMBL6326123 0.82 GSK3B (0.51) GSK3BCDK4PRKCBCDK2PDK1
SCHEMBL6328005 0.76 CDK4 (0.35) CDK4CAMK2DCCND1
SCHEMBL6806993 0.74 GSK3B (0.58) GSK3BCDK4PRKCBCDK2PDK1
SCHEMBL1395908 0.73 CDK4 (0.51) GSK3BCDK4PRKCBCDK2PDK1
SCHEMBL6328643 0.73 CAMK2D (0.49) GSK3BCDK4PRKCBCDK2PDK1
SCHEMBL6799174 0.72 GSK3B (0.54) GSK3BCDK4PRKCBCDK2PDK1
SCHEMBL6801053 0.72 GSK3B (0.56) GSK3BCDK4PRKCBCDK2PDK1
SCHEMBL6325776 0.72 CDK4 (0.40) GSK3BCDK4PRKCBCDK2PDK1

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 GSK3B 668/4885CDK4 5/4885PRKCB 160/4885

“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.