SCHEMBL4193315

SCHEMBL4193315

CN1CCC(S(=O)(=O)N2CC[CH]CC2)CC1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SMYD3 Q9H7B4 1/20 0.39
HTR2A P28223 9/20 0.33
HTR2C P28335 9/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
HTR6 P50406 1/20 0.33
BRD4 O60885 1/20 0.32
POLB P06746 1/20 0.32
APOBEC3A P31941 1/20 0.31
APOBEC3G Q9HC16 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
MAPT P10636 1/20 0.31
HTT P42858 1/20 0.31

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
SCHEMBL1380380 0.85 EPHX2 (0.38)
SCHEMBL20111953 0.83 SMYD3 (0.40) SMYD3L3MBTL1POLBAPOBEC3AAPOBEC3G
SCHEMBL28947181 0.81 EPHX2 (0.43) HTR6MEN1KMT2AHTT
SCHEMBL4193328 0.79 LMNA (0.36)
SCHEMBL10192196 0.76 POLB (0.41) L3MBTL1POLBAPOBEC3AAPOBEC3GMEN1
SCHEMBL8220866 0.76 CA12 (0.46) SMYD3L3MBTL1POLBMAPT
SCHEMBL20535845 0.76 ABL1 (0.38) L3MBTL1POLB
SCHEMBL4196480 0.76 LMNA (0.48) SMYD3HTR6BRD4MAPT
SCHEMBL4197832 0.74 SMYD3 (0.38) SMYD3HTR2AHTR2CHTR6POLB
SCHEMBL24477829 0.73 SMYD3 (0.38) SMYD3HTR2AHTR2C

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 5 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
CN-101500569-A HIF hydroxylase inhibitors for treatment of anemia of cancer FIBROGEN INC (US) 2009-08-05 CN disclosed
CN-101490041-A 2-heterocycloamino-4-imidazolylpyrimidines as agents for the inhibition of cell proliferation ASTRAZENECA AB (SE) 2009-07-22 CN 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 4052/4885HTR2A 4343/4885HTR2C 3425/4885

“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.