SCHEMBL4203232

SCHEMBL4203232

CN(CCCS(=O)(=O)N1CC[CH]CC1)CC1CC1

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
CYP2D6 P10635 2/20 0.32
RECQL P46063 1/20 0.32
LSS P48449 1/20 0.32
IKBKB O14920 1/20 0.32
CHUK O15111 1/20 0.32
KDM4E B2RXH2 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2C19 P33261 1/20 0.31
BRD4 O60885 1/20 0.31
KDM2B Q8NHM5 1/20 0.30

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
SCHEMBL4202153 0.91 CYP2D6 (0.32) ALDH1A1CYP2D6KDM4ECYP1A2CYP2C19
SCHEMBL4202856 0.82 CYP2D6 (0.32) CYP2D6RECQLIKBKBCHUKKDM4E
SCHEMBL4199003 0.80 BRD4 (0.36) ALDH1A1IKBKBCHUKBRD4
SCHEMBL4207795 0.79 TSHR (0.34) ALDH1A1CYP2D6LSSIKBKBCHUK
SCHEMBL4508646 0.78 TSHR (0.33) ALDH1A1CYP2D6RECQLIKBKBCHUK
SCHEMBL4505043 0.77 TSHR (0.33) ALDH1A1CYP2D6RECQLIKBKBCHUK
SCHEMBL4203465 0.77 SMYD3 (0.38)
SCHEMBL4205046 0.76 KMT2A (0.34) ALDH1A1
SCHEMBL4203149 0.76
SCHEMBL4197849 0.74 LMNA (0.43) IKBKBKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090275567-A1 2-HETEROCYCLOAMINO-4-IMIDAZOLYLPYRIMIDINES AS AGENTS FOR THE INHIBITION OF CELL PROLIFERATION ASTRAZENECA AB (SE) 2009-11-05 US disclosed
EP-2032559-A1 2-HETEROCYCLOAMINO-4-IMIDAZOLYLPYRIMIDINES AS AGENTS FOR THE INHIBITION OF CELL PROLIFERATION AstraZeneca AB (SE) 2009-03-11 EP disclosed
WO-2007138268-A1 2-HETEROCYCLOAMINO-4-IMIDAZOLYLPYRIMIDINES AS AGENTS FOR THE INHIBITION OF CELL PROLIFERATION ASTRAZENECA AB (SE) 2007-12-06 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-20090275567-A1 2-HETEROCYCLOAMINO-4-IMIDAZOLYLPYRIMIDINES AS AGENTS FOR THE INHIBITION OF CELL PROLIFERATION CCNI, MKI67, CDK2 ALDH1A1 537/4885CYP2D6 1725/4885RECQL 909/4885

“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.