SCHEMBL13740926

SCHEMBL13740926

CC(=O)Oc1c(Cl)c(C)nc(C(Cl)(Cl)Cl)c1Cl

nearest known ligand 0.31

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.31
LMNA P02545 1/20 0.31
PKM P14618 1/20 0.31
ABCB11 O95342 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL13741538 0.84 L3MBTL1 (0.32) KDM4ELMNAPKML3MBTL1
SCHEMBL13272289 0.83 ABCB11 (0.30) ABCB11
SCHEMBL13741310 0.83 NCEH1 (0.38) KDM4ELMNA
SCHEMBL13740695 0.81 KDM4E (0.40) KDM4ELMNAPKML3MBTL1
SCHEMBL13272290 0.81 ABCB11 (0.32) ABCB11
SCHEMBL10013346 0.81 ABCB11 (0.35) ABCB11
SCHEMBL13740927 0.77 IDO1 (0.40) LMNAPKML3MBTL1
SCHEMBL13740928 0.75 ATM (0.43) LMNAL3MBTL1
SCHEMBL13741535 0.75 TSHR (0.49)
SCHEMBL30543939 0.75 ABCB11 (0.34) KDM4EABCB11L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090197844-A1 Demethylpenclomedine Analogs and Their Use as Anti-Cancer Agents DEKK-TEC, INC. 2009-08-06 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-20090197844-A1 Demethylpenclomedine Analogs and Their Use as Anti-Cancer Agents MCL1, DNMT1, MYC KDM4E 42/4885LMNA 1636/4885PKM 1325/4885

“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.