SCHEMBL3311604

SCHEMBL3311604

CC(O)C(=O)N1CCC([O])C1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.41
ALDH1A1 P00352 1/20 0.41
KMT2A Q03164 1/20 0.41
DPP4 P27487 10/20 0.40
DPP7 Q9UHL4 6/20 0.40
DPP8 Q6V1X1 4/20 0.40
DPP9 Q86TI2 3/20 0.40
ROCK2 O75116 1/20 0.35
CYP3A4 P08684 1/20 0.35
CHRNB2 P17787 1/20 0.34
CHRNA3 P32297 1/20 0.34
CHRNA4 P43681 1/20 0.34
CHRNB3 Q05901 1/20 0.34
CHRNA6 Q15825 1/20 0.34

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
SCHEMBL3318469 0.87 MEN1 (0.48) MEN1ALDH1A1KMT2ADPP4DPP7
SCHEMBL3313734 0.85 CHRNB2 (0.42) MEN1ALDH1A1KMT2ACHRNB2CHRNA3
SCHEMBL12801568 0.82 DPP4 (0.58) MEN1ALDH1A1KMT2ADPP4DPP7
SCHEMBL25798260 0.82 DPP4 (0.58) MEN1ALDH1A1KMT2ADPP4DPP7
SCHEMBL12801567 0.82 DPP4 (0.58) MEN1ALDH1A1KMT2ADPP4DPP7
SCHEMBL3311606 0.82 DPP4 (0.58) MEN1ALDH1A1KMT2ADPP4DPP7
SCHEMBL2249766 0.80 DPP4 (0.45) MEN1ALDH1A1KMT2ADPP4DPP7
SCHEMBL20385048 0.80 DPP4 (0.45) MEN1ALDH1A1KMT2ADPP4DPP7
SCHEMBL2249769 0.80 DPP4 (0.45) MEN1ALDH1A1KMT2ADPP4DPP7
SCHEMBL3397414 0.80 DPP4 (0.45) MEN1ALDH1A1KMT2ADPP4DPP7

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
WO-2010049731-A1 PYRAZOLO- AND IMIDAZOPYRIDINYLPYRIMIDINEAMINES AS IGF-1R TYROSINE KINASE INHIBITORS ASTRAZENECA AB (SE) 2010-05-06 WO disclosed
US-20100105655-A1 NOVEL COMPOUNDS 515 ASTRAZENECA AB 2010-04-29 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-20100105655-A1 NOVEL COMPOUNDS 515 TYMS, ABCG2, UMPS MEN1 3480/4885ALDH1A1 649/4885KMT2A 3784/4885

“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.