SCHEMBL1447249

SCHEMBL1447249

CN(C)C1CCN(C(=O)c2ccc(I)cc2)C1

nearest known ligand 0.69

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
L3MBTL3 Q96JM7 2/20 0.69
L3MBTL1 Q9Y468 1/20 0.57
HRH3 Q9Y5N1 8/20 0.56
PDK2 Q15119 1/20 0.51
MGLL Q99685 1/20 0.50
JAK2 O60674 1/20 0.47
MCHR1 Q99705 1/20 0.47
HDAC4 P56524 1/20 0.46
ATR Q13535 1/20 0.46

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
SCHEMBL1447315 1.00 L3MBTL3 (0.69) L3MBTL3L3MBTL1HRH3PDK2MGLL
SCHEMBL1447551 1.00 L3MBTL3 (0.69) L3MBTL3L3MBTL1HRH3PDK2MGLL
SCHEMBL17271879 0.91 L3MBTL3 (0.84) L3MBTL3L3MBTL1HRH3MGLLHDAC4
SCHEMBL25975209 0.88 L3MBTL3 (0.58) L3MBTL3L3MBTL1HRH3PDK2MGLL
SCHEMBL24185230 0.87 L3MBTL3 (0.71) L3MBTL3L3MBTL1HRH3PDK2MGLL
SCHEMBL12237840 0.87 L3MBTL3 (0.71) L3MBTL3L3MBTL1HRH3PDK2MGLL
SCHEMBL12237837 0.87 L3MBTL3 (0.71) L3MBTL3L3MBTL1HRH3PDK2MGLL
SCHEMBL24185235 0.87 L3MBTL3 (0.71) L3MBTL3L3MBTL1HRH3PDK2MGLL
SCHEMBL2887400 0.87 L3MBTL3 (0.71) L3MBTL3L3MBTL1HRH3PDK2MGLL
SCHEMBL10195734 0.87 L3MBTL3 (0.71) L3MBTL3L3MBTL1HRH3PDK2MGLL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2301928-A1 Imidazolyl-pyrimidine compounds for use in the treatment of proliferative disorders AstraZeneca AB (SE) 2011-03-30 EP disclosed
US-7745428-B2 Imidazo[1,2-A]pyridine having anti-cell-proliferation activity ASTRAZENECA AB (SE) 2010-06-29 US disclosed
US-20090054409-A1 IMIDAZO [1,2-A] PYRIDINE HAVING ANTI-CELL-PROLIFERATION ACTIVITY ASTRAZENECA AB (SE) 2009-02-26 US disclosed
US-20080280906-A1 Imidazolyl-Pyrimidine Compounds for Use in the Treatment of Proliferative Disorders ASTRAZENECA AB (SE) 2008-11-13 US disclosed
EP-1912974-A1 IMIDAZOLYL-PYRIMIDINE COMPOUNDS FOR USE IN THE TREATMENT OF PROLIFERATIVE DISORDERS AstraZeneca AB (SE) 2008-04-23 EP disclosed
WO-2007015064-A1 IMIDAZOLYL-PYRIMIDINE COMPOUNDS FOR USE IN THE TREATMENT OF PROLIFERATIVE DISORDERS ASTRAZENECA AB (SE) 2007-02-08 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 (2 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-20090054409-A1 IMIDAZO [1,2-A] PYRIDINE HAVING ANTI-CELL-PROLIFERATION ACTIVITY MKI67, CCNI, CCNA1 L3MBTL3 3559/4885L3MBTL1 2917/4885HRH3 2041/4885
US-20080280906-A1 Imidazolyl-Pyrimidine Compounds for Use in the Treatment of Proliferative Disorders CCNI, MKI67, TYMP L3MBTL3 3141/4885L3MBTL1 2832/4885HRH3 2679/4885

“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.