SCHEMBL15217801

SCHEMBL15217801

CN1CCN(N2CCN(C3CC3)CC2)CC1

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.36
L3MBTL3 Q96JM7 1/20 0.36
PIM1 P11309 1/20 0.36
HRH3 Q9Y5N1 3/20 0.36
ALDH1A1 P00352 4/20 0.33
KDM4E B2RXH2 4/20 0.33
TDP1 Q9NUW8 1/20 0.33
KCNH2 Q12809 1/20 0.32
NCF1 P14598 1/20 0.32
ACHE P22303 1/20 0.32
ALOX15 P16050 1/20 0.32
IRAK4 Q9NWZ3 1/20 0.31
RAD52 P43351 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
SCHEMBL19496237 0.92 L3MBTL1 (0.39) L3MBTL1L3MBTL3PIM1HRH3ALDH1A1
SCHEMBL81624 0.92 L3MBTL1 (0.39) L3MBTL1L3MBTL3PIM1HRH3ALDH1A1
SCHEMBL22519024 0.86 L3MBTL1 (0.41) L3MBTL1L3MBTL3PIM1HRH3ALDH1A1
SCHEMBL18563138 0.84 KDM4E (0.38) L3MBTL1L3MBTL3PIM1HRH3ALDH1A1
SCHEMBL3436969 0.83 L3MBTL1 (0.46) L3MBTL1L3MBTL3PIM1HRH3ALDH1A1
SCHEMBL12772837 0.83 L3MBTL3 (0.46) L3MBTL1L3MBTL3PIM1HRH3ALDH1A1
SCHEMBL736095 0.82 KDM4E (0.47) L3MBTL1L3MBTL3PIM1HRH3ALDH1A1
SCHEMBL1646548 0.82 KDM4E (0.47) L3MBTL1L3MBTL3PIM1HRH3ALDH1A1
SCHEMBL736305 0.82 KDM4E (0.47) L3MBTL1L3MBTL3PIM1HRH3ALDH1A1
SCHEMBL82229 0.82 KDM4E (0.50) L3MBTL1L3MBTL3PIM1HRH3ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130225528-A1 Phosphorus Derivatives as Kinase Inhibitors ARIAD PHARMACEUTICALS, INC. (US) 2013-08-29 US 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-20130225528-A1 Phosphorus Derivatives as Kinase Inhibitors PHKA1, PIK3CA, PHKA2 L3MBTL1 4738/4885L3MBTL3 4709/4885PIM1 327/4885

“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.