SCHEMBL6329407

SCHEMBL6329407

COC(=O)C(=O)c1cn2c3c(cc(F)cc13)CCC2C

nearest known ligand 0.65

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.65
SMN1; SMN2 Q16637 1/20 0.65
CYP1A2 P05177 1/20 0.65
HTR2A P28223 3/20 0.53
HTR2C P28335 3/20 0.53
PDE4A P27815 1/20 0.52
PDE4B Q07343 1/20 0.52
PDE4C Q08493 1/20 0.52
PDE4D Q08499 1/20 0.52
HIF1A Q16665 3/20 0.38
TLR2 O60603 6/20 0.38
LMNA P02545 3/20 0.38
ALDH1A1 P00352 3/20 0.38
HTT P42858 3/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
TSHR P16473 2/20 0.37
RXFP1 Q9HBX9 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
SCHEMBL11746236 0.83 KDM4E (0.77) KDM4ESMN1; SMN2CYP1A2HTR2AHTR2C
SCHEMBL6334232 0.81 KDM4E (0.44) KDM4ESMN1; SMN2CYP1A2HTR2AHTR2C
Flumequine SCHEMBL49829 0.79 KDM4E (1.00) KDM4ESMN1; SMN2CYP1A2HTR2AHTR2C
SCHEMBL5796602 0.79 KDM4E (0.39) KDM4ESMN1; SMN2CYP1A2HTR2AHTR2C
Flumequine SCHEMBL29465201 0.79 KDM4E (1.00) KDM4ESMN1; SMN2CYP1A2HTR2AHTR2C
Flumequine SCHEMBL30767693 0.79 KDM4E (1.00) KDM4ESMN1; SMN2CYP1A2HTR2AHTR2C
Flumequine SCHEMBL49830 0.79 KDM4E (1.00) KDM4ESMN1; SMN2CYP1A2HTR2AHTR2C
SCHEMBL13923336 0.78 KDM4E (0.77) KDM4ESMN1; SMN2CYP1A2HTR2AHTR2C
SCHEMBL11747062 0.78 KDM4E (0.80) KDM4ESMN1; SMN2CYP1A2HTR2AHTR2C
SCHEMBL11742001 0.78 KDM4E (0.80) KDM4ESMN1; SMN2CYP1A2HTR2AHTR2C

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 KDM4E 2625/4885SMN1; SMN2 2878/4885CYP1A2 3552/4885

“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.