SCHEMBL4299683

SCHEMBL4299683

CCN(C(=O)C1CCCN(C2CCN(C(=O)OC(C)(C)C)CC2)C1)C(C)C

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
HPGD P15428 1/20 0.43
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
ALDH1A1 P00352 3/20 0.42
MAPT P10636 1/20 0.42
ACACB O00763 1/20 0.41
ACACA Q13085 1/20 0.41
PKM P14618 1/20 0.41
USP30 Q70CQ3 1/20 0.40
PARP1 P09874 1/20 0.39
RECQL P46063 1/20 0.39
EPHX1 P07099 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.38
HCAR1 Q9BXC0 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
SCHEMBL7028601 0.86 ACACB (0.53) KDM4EL3MBTL1HPGDMEN1KMT2A
SCHEMBL13609483 0.80 SMN1; SMN2 (0.40) KDM4EL3MBTL1MEN1KMT2AALDH1A1
SCHEMBL6182800 0.78 MEN1 (0.52) KDM4EL3MBTL1HPGDMEN1KMT2A
SCHEMBL5943739 0.78 MEN1 (0.52) KDM4EL3MBTL1HPGDMEN1KMT2A
SCHEMBL13575410 0.77 HPGD (0.50) HPGDMEN1KMT2AALDH1A1MAPT
SCHEMBL31482131 0.77 HPGD (0.47) KDM4EHPGDMEN1KMT2AALDH1A1
SCHEMBL14978892 0.76 CHRM1 (0.57) KDM4EL3MBTL1MEN1KMT2AALDH1A1
SCHEMBL16845137 0.75 HPGD (0.50) HPGDMEN1KMT2AALDH1A1MAPT
SCHEMBL31482125 0.75 HPGD (0.45) HPGDMEN1KMT2AALDH1A1MAPT
SCHEMBL16823903 0.75 HPGD (0.48) HPGDMEN1KMT2AALDH1A1MAPT

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
US-20090281097-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-11-12 US disclosed
US-20090281097-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-11-12 US disclosed
US-20090281097-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-11-12 US disclosed
EP-2009011-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND Takeda Pharmaceutical Company Limited (JP) 2008-12-31 EP 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-20090281097-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND TNNC1, CPT1B, TNNI3 KDM4E 1496/4885L3MBTL1 1416/4885HPGD 595/4885

“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.