SCHEMBL8739702

SCHEMBL8739702

CC1(C)CC(NC(=O)c2ccc(OC3CNC3)c(Cl)c2)CC(C)(C)N1

nearest known ligand 0.65

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.65
KMT2A Q03164 3/20 0.65
EZH2 Q15910 10/20 0.61
GLA P06280 1/20 0.55
CYP2C9 P11712 1/20 0.52
PKM P14618 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
POLB P06746 1/20 0.50

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
SCHEMBL8739662 0.92 MEN1 (0.60) MEN1KMT2AEZH2GLACYP2C9
SCHEMBL8739260 0.90 MEN1 (0.58) MEN1KMT2AEZH2GLACYP2C9
SCHEMBL8739673 0.89 MEN1 (0.62) MEN1KMT2AEZH2GLACYP2C9
SCHEMBL8738911 0.81 MEN1 (0.59) MEN1KMT2AEZH2GLACYP2C9
SCHEMBL6119756 0.80 EZH2 (0.77) MEN1KMT2AEZH2
SCHEMBL6120920 0.79 MEN1 (0.77) MEN1KMT2AEZH2GLACYP2C9
SCHEMBL8738112 0.79 EZH2 (0.79) MEN1KMT2AEZH2GLA
SCHEMBL8738618 0.78 EZH2 (0.74) MEN1KMT2AEZH2
SCHEMBL8739024 0.77 EZH2 (0.69) MEN1KMT2AEZH2L3MBTL1
SCHEMBL8739463 0.77 EZH2 (0.73) MEN1KMT2AEZH2

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-20130310379-A1 MODULATORS OF METHYL MODIFYING ENZYMES, COMPOSITIONS AND USES THEREOF CONSTELLATION PHARMACEUTICALS (US) 2013-11-21 US disclosed
WO-2012068589-A2 MODULATORS OF METHYL MODIFYING ENZYMES, COMPOSITIONS AND USES THEREOF CONSTELLATION PHARMACEUTICALS (US) 2012-05-24 WO 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-20130310379-A1 MODULATORS OF METHYL MODIFYING ENZYMES, COMPOSITIONS AND USES THEREOF TET1, TET3, EHMT2 MEN1 2650/4885KMT2A 84/4885EZH2 61/4885

“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.