SCHEMBL4292000

SCHEMBL4292000

O=C(O)N1CCC(N2CCNC(C(=O)N3CCOCC3)C2)CC1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 1/20 0.43
KCNH2 Q12809 1/20 0.43
LMNA P02545 1/20 0.41
ACACB O00763 3/20 0.38
ACACA Q13085 3/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
ADRA1A P35348 2/20 0.37
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
L3MBTL3 Q96JM7 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
HRH3 Q9Y5N1 4/20 0.36
DPP4 P27487 1/20 0.36
EPHX2 P34913 1/20 0.34

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
SCHEMBL4297927 0.82 RECQL (0.59) CCR2KCNH2LMNAKDM4E
SCHEMBL4315788 0.75 L3MBTL3 (0.57) LMNAACACBACACAKDM4EALDH1A1
SCHEMBL29904551 0.71 DPP4 (0.40) LMNAMEN1KMT2AALDH1A1L3MBTL1
SCHEMBL3335183 0.70 DPP4 (0.57) MEN1KMT2ADPP4
SCHEMBL3335187 0.70 DPP4 (0.57) MEN1KMT2ADPP4
SCHEMBL3834001 0.70 DPP4 (0.57) MEN1KMT2ADPP4
SCHEMBL10326190 0.69 DPP4 (0.51) MEN1KMT2AALDH1A1DPP4
SCHEMBL6110276 0.69 L3MBTL3 (0.50) LMNAKDM4EALDH1A1L3MBTL3L3MBTL1
SCHEMBL29267150 0.69 L3MBTL3 (0.50) LMNAKDM4EALDH1A1L3MBTL3L3MBTL1
SCHEMBL13735071 0.69 DPP4 (0.40) LMNAKDM4EALDH1A1L3MBTL1DPP4

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-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 CCR2 1625/4885KCNH2 816/4885LMNA 339/4885

“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.