SCHEMBL1448240

SCHEMBL1448240

CN[C@@H]1CCN(C(=O)c2ccc(I)cc2)C1

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 1/20 0.51
KDM1A O60341 4/20 0.50
HRH4 Q9H3N8 3/20 0.50
MGLL Q99685 1/20 0.50
EPHX1 P07099 1/20 0.46
L3MBTL3 Q96JM7 2/20 0.45
CDK1 P06493 2/20 0.45
CDK2 P24941 2/20 0.45
L3MBTL1 Q9Y468 1/20 0.44
EPHX2 P34913 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43

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
SCHEMBL22184356 0.87 PDK2 (0.52) PDK2KDM1AHRH4MGLLEPHX1
SCHEMBL14392680 0.87 PDK2 (0.52) PDK2KDM1AHRH4MGLLEPHX1
SCHEMBL14924420 0.87 KDM1A (0.63) PDK2KDM1AHRH4MGLLCDK1
SCHEMBL22859014 0.85 POLB (0.54) PDK2KDM1AHRH4MGLLEPHX1
SCHEMBL1447790 0.85 MGLL (0.50) KDM1AMGLLEPHX1L3MBTL3CDK1
SCHEMBL2132882 0.85 EPHX1 (0.63) PDK2KDM1AHRH4EPHX1L3MBTL3
SCHEMBL2132888 0.85 EPHX1 (0.63) PDK2KDM1AHRH4EPHX1L3MBTL3
SCHEMBL7881494 0.85 EPHX1 (0.63) PDK2KDM1AHRH4EPHX1L3MBTL3
SCHEMBL1447944 0.83 MGLL (0.48) MGLLEPHX1L3MBTL3L3MBTL1EPHX2
SCHEMBL1447941 0.83 MGLL (0.48) MGLLEPHX1L3MBTL3L3MBTL1EPHX2

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
EP-2301928-A1 Imidazolyl-pyrimidine compounds for use in the treatment of proliferative disorders AstraZeneca AB (SE) 2011-03-30 EP disclosed
US-20080280906-A1 Imidazolyl-Pyrimidine Compounds for Use in the Treatment of Proliferative Disorders ASTRAZENECA AB (SE) 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-20080280906-A1 Imidazolyl-Pyrimidine Compounds for Use in the Treatment of Proliferative Disorders CCNI, MKI67, TYMP PDK2 244/4885KDM1A 3180/4885HRH4 3170/4885

“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.