SCHEMBL6802576

SCHEMBL6802576

CC(C)(C)OC(=O)C1Cn2ccc3c(C4=C(c5cn6c7c(cc(F)cc57)C(C)(C)CC6)C(=O)NC4=O)ccc(c32)CN1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 19/20 0.37
GSK3A P49840 12/20 0.37
CDK4 P11802 5/20 0.37
PRKCB P05771 4/20 0.37
CDK2 P24941 3/20 0.37
CDK5 Q00535 2/20 0.37
PDK1 Q15118 2/20 0.37
CAMK2B Q13554 2/20 0.37
CAMK2G Q13555 2/20 0.37
CAMK2D Q13557 2/20 0.37
PDPK1 O15530 1/20 0.37
PRKCG P05129 1/20 0.37
LCK P06239 1/20 0.37
CDK1 P06493 1/20 0.37
PIM1 P11309 1/20 0.37
MARK3 P27448 1/20 0.37
CLK2 P49760 1/20 0.37
RPS6KA3 P51812 1/20 0.37
PRKCD Q05655 1/20 0.37
PRKAA1 Q13131 1/20 0.37

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
SCHEMBL6801058 0.90 GSK3B (0.43) GSK3BGSK3ACDK4PRKCBCDK2
SCHEMBL6806997 0.81 GSK3B (0.46) GSK3BGSK3ACDK4PRKCBCDK2
SCHEMBL6802119 0.80 GSK3B (0.54) GSK3BGSK3A
SCHEMBL6799178 0.79 GSK3B (0.42) GSK3BGSK3ACDK4PRKCBCDK2
SCHEMBL6803328 0.79 GSK3B (0.41) GSK3BGSK3ACDK4PRKCBCDK2
SCHEMBL6850793 0.74 GSK3B (0.43) GSK3BGSK3ACDK4PRKCBCDK2
SCHEMBL6802110 0.73 GSK3B (0.59) GSK3BGSK3A
SCHEMBL6328005 0.70 CDK4 (0.35) CDK4CAMK2DCCND1
SCHEMBL3050218 0.69 MEN1 (0.30)
SCHEMBL6327468 0.69 CDK4 (0.35) GSK3BGSK3ACDK4PRKCBCDK2

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-1250334-B1 Medicaments useful for the treatment of proliferative diseases LILLY CO ELI (US) 2004-05-19 EP claimed
US-6743785-B2 KINASE INHIBITORS; ANNULATED PYRROLE AND INDOLE RINGS; PYRROLO (3,2,1-HI)INDOLES; 3-(5,5-DIMETHYL-5,6-DIHYDRO-4H-PYRROLO (3,2,1-IJ)QUINOLIN-1-YL)-4-(1,2,3,4-TETRAHYDRO-(1,4) DIAZEPINO(6,7,1-HI)INDOL-7-YL)-PYRROLE-2,5-DIONE ELI LILLY AND COMPANY 2004-06-01 US disclosed
EP-1250334-B1 Medicaments useful for the treatment of proliferative diseases LILLY CO ELI (US) 2004-05-19 EP disclosed
US-20030092676-A1 Agents and method for the treatment of proliferative diseases ELI LILLY AND COMPANY 2003-05-15 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-20030092676-A1 Agents and method for the treatment of proliferative diseases MKI67, CDKN1A, CDK4 GSK3B 761/4885GSK3A 699/4885CDK4 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.