SCHEMBL6328643

SCHEMBL6328643

CC(C)(C)OC(=O)NCc1ccc2c(C3=C(c4cn5c6c(cccc46)CCC5)C(=O)NC3=O)c[nH]c2c1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CAMK2D Q13557 3/20 0.49
CDK4 P11802 5/20 0.48
CCND1 P24385 4/20 0.48
PRKACA P17612 2/20 0.48
PRKACG P22612 2/20 0.48
PRKACB P22694 2/20 0.48
MTNR1A P48039 3/20 0.40
MTNR1B P49286 3/20 0.40
GSK3B P49841 4/20 0.39
GSK3A P49840 3/20 0.39
OPA1 O60313 1/20 0.38
EIF5B O60841 1/20 0.38
MET P08581 1/20 0.38
HMOX2 P30519 1/20 0.38
CTSL P07711 1/20 0.38
PRKCB P05771 1/20 0.38
CDK2 P24941 1/20 0.38
PDK1 Q15118 1/20 0.38

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
SCHEMBL6334227 0.83 CDK4 (0.50) CDK4CCND1PRKACAPRKACGPRKACB
SCHEMBL6327402 0.82 CDK4 (0.47) CDK4CCND1PRKACAPRKACGPRKACB
SCHEMBL6327674 0.82 CDK4 (0.50) CAMK2DCDK4CCND1PRKACAPRKACG
SCHEMBL6327449 0.79 CDK4 (0.59) CAMK2DCDK4CCND1PRKACAPRKACG
SCHEMBL6327465 0.79 CDK4 (0.56) CAMK2DCDK4CCND1PRKACAPRKACG
SCHEMBL6332262 0.79 CDK4 (0.68) CAMK2DCDK4CCND1PRKACAPRKACG
SCHEMBL6326531 0.79 CDK4 (0.56) CDK4CCND1PRKACAPRKACGPRKACB
SCHEMBL6328457 0.78 CDK4 (0.46) CAMK2DCDK4CCND1PRKACAPRKACG
SCHEMBL224940 0.78 CDK4 (0.61) CAMK2DCDK4CCND1PRKACAPRKACG
SCHEMBL6329215 0.78 CDK4 (0.53) CDK4CCND1PRKACAPRKACGPRKACB

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 CAMK2D 896/4885CDK4 5/4885CCND1 70/4885

“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.