SCHEMBL13061313

SCHEMBL13061313

CC(C)(C)OC(=O)N(CC=CCl)c1cc(O)c2ccccc2c1I

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 1/20 0.30
HDAC8 Q9BY41 1/20 0.30
HDAC6 Q9UBN7 1/20 0.30
STAT5B P51692 1/20 0.30
BRD4 O60885 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
SCHEMBL5095964 0.85 BRD4 (0.30) BRD4
SCHEMBL18089490 0.84
SCHEMBL12154966 0.83 L3MBTL1 (0.34) HDAC8
SCHEMBL14301796 0.83
SCHEMBL14587285 0.80 KDM4E (0.33)
SCHEMBL20297003 0.77 L3MBTL1 (0.35) BRD4
SCHEMBL5865339 0.77 TLR9 (0.33) BRD4
SCHEMBL5865337 0.77 TLR9 (0.33) BRD4
SCHEMBL15286185 0.76 NPSR1 (0.36)
SCHEMBL14587288 0.76 NPSR1 (0.37) HDAC1HDAC8HDAC6

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-7847105-B2 Methods and compounds for preparing CC-1065 analogs MEDAREX, INC. (US) 2010-12-07 US disclosed
US-20080281102-A1 Methods and Compounds For Preparing Cc-1065 Analogs MEDAREX, INC. (US) 2008-11-13 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-20080281102-A1 Methods and Compounds For Preparing Cc-1065 Analogs CCNI, CBR3, CNR1 HDAC1 4178/4885HDAC8 4373/4885HDAC6 4446/4885

“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.