SCHEMBL4207692

SCHEMBL4207692

O=S(=O)(CCCN1CCC1)N1CC[CH]CC1

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SMYD3 Q9H7B4 1/20 0.39
LOX P28300 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
HRH3 Q9Y5N1 4/20 0.34
ALOX15 P16050 1/20 0.34
IKBKB O14920 3/20 0.33
HTR4 Q13639 2/20 0.33
MBTD1 Q05BQ5 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
KCNH2 Q12809 1/20 0.32
CYP1A2 P05177 1/20 0.32
MAPK1 P28482 1/20 0.32

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
SCHEMBL4354178 0.96 SMYD3 (0.41) SMYD3LOXSMN1; SMN2HRH3ALOX15
SCHEMBL4202177 0.95 HRH3 (0.42) SMYD3LOXSMN1; SMN2HRH3ALOX15
SCHEMBL4203206 0.89 PARP1 (0.36) SMYD3LOXSMN1; SMN2ALOX15
SCHEMBL4343696 0.86 SMYD3 (0.37) SMYD3LOXSMN1; SMN2HRH3ALOX15
SCHEMBL4195676 0.86 HTR4 (0.38) SMYD3HTR4L3MBTL1
SCHEMBL4194787 0.85 PARP1 (0.39) SMYD3LOXSMN1; SMN2HRH3ALOX15
SCHEMBL4195076 0.85 KMT2A (0.42) SMN1; SMN2HRH3IKBKBHTR4
SCHEMBL4190804 0.85 ALDH1A1 (0.39) SMYD3SMN1; SMN2HRH3HTR4KCNH2
SCHEMBL4205217 0.84 PARP1 (0.41) LOXSMN1; SMN2HRH3ALOX15L3MBTL1
SCHEMBL4505037 0.77 PAOX (0.36) HRH3HTR4L3MBTL1

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 SMYD3 4052/4885LOX 3010/4885SMN1; SMN2 1708/4885

“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.