SCHEMBL4207698

SCHEMBL4207698

O=S(=O)(NCCCN1CC[C@H](F)C1)N1CC[CH]CC1

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.46
HTR7 P34969 6/20 0.34
CCR3 P51677 2/20 0.33
HRH3 Q9Y5N1 3/20 0.32
BDKRB1 P46663 1/20 0.32
MBTD1 Q05BQ5 1/20 0.32
HTR1A P08908 1/20 0.31
HTR2A P28223 1/20 0.31
KMT2A Q03164 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
SCHEMBL4199008 0.80 L3MBTL1 (0.48) L3MBTL1HTR7MBTD1KMT2A
SCHEMBL4202733 0.79 L3MBTL1 (0.47) L3MBTL1HTR7HRH3MBTD1
SCHEMBL4195054 0.76 L3MBTL1 (0.34) L3MBTL1HTR7
SCHEMBL4199423 0.76 L3MBTL1 (0.34) L3MBTL1HTR7
SCHEMBL4200851 0.70 SIGMAR1 (0.45) L3MBTL1MBTD1
SCHEMBL4195788 0.68 HDAC2 (0.36) HTR7
SCHEMBL4357843 0.66 ALOX15 (0.33) KMT2A
SCHEMBL4504070 0.66 ALDH1A1 (0.45) HRH3
SCHEMBL2116555 0.65 HRH3 (0.39) L3MBTL1HTR7HRH3HTR1A
SCHEMBL15884621 0.65 KDM4E (0.44) L3MBTL1HRH3

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 L3MBTL1 3228/4885HTR7 3381/4885CCR3 4504/4885

“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.