SCHEMBL4038008

SCHEMBL4038008

[CH2]N1CCN(C(C)C(N)=O)CC1

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
GAA P10253 1/20 0.32
CYP2D6 P10635 1/20 0.30
KCNH2 Q12809 1/20 0.30
HRH3 Q9Y5N1 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
SCHEMBL16026595 0.89 MEN1 (0.37) MEN1KMT2AGAACYP2D6KCNH2
SCHEMBL23278004 0.82 HRH3 (0.39) MEN1KMT2ACYP2D6KCNH2HRH3
SCHEMBL4724913 0.81 PIK3CD (0.47) KMT2ACYP2D6KCNH2HRH3
SCHEMBL4723629 0.81 PIK3CD (0.47) KMT2ACYP2D6KCNH2HRH3
SCHEMBL4038010 0.80 KDM4E (0.44) MEN1KMT2A
SCHEMBL19044557 0.80 KDM4E (0.44) MEN1KMT2A
SCHEMBL19044559 0.80 KDM4E (0.44) MEN1KMT2A
SCHEMBL1303572 0.79 ATM (0.41) MEN1KMT2AGAA
SCHEMBL1613168 0.79 ATM (0.41) MEN1KMT2AGAA
SCHEMBL19517200 0.79 ATM (0.41) MEN1KMT2AGAA

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
US-20090048269-A1 CHEMICAL COMPOUNDS-821 ASTRAZENECA AB (SE) 2009-02-19 US disclosed
WO-2009022171-A1 PYRIDINYIIOXY PYRIDINES AS ALK5 INHIBITORS ASTRAZENECA AB (SE) 2009-02-19 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-20090048269-A1 CHEMICAL COMPOUNDS-821 TGFBR1, TGFBR2, SMAD3 MEN1 218/4885KMT2A 2976/4885GAA 1418/4885

“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.