SCHEMBL3317065

SCHEMBL3317065

COc1ccc(C2CCN(C(=O)OC(C)(C)C)CC2)cc1N

nearest known ligand 0.62

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 11/20 0.62
MEN1 O00255 1/20 0.52
KMT2A Q03164 1/20 0.52
STS P08842 1/20 0.51
NAMPT P43490 1/20 0.50
QDPR P09417 1/20 0.50
PDE4A P27815 3/20 0.49
PDE4C Q08493 3/20 0.49
PDE4D Q08499 3/20 0.49
KDM4E B2RXH2 1/20 0.49
MAPT P10636 1/20 0.49
THRB P10828 1/20 0.49
HTT P42858 1/20 0.47
ALDH1A1 P00352 1/20 0.47
USP30 Q70CQ3 1/20 0.47

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
SCHEMBL310046 0.91 PDE4B (0.62) PDE4BMEN1KMT2ASTSNAMPT
SCHEMBL30957975 0.91 PDE4B (0.62) PDE4BMEN1KMT2ASTSNAMPT
SCHEMBL30778326 0.88 NAMPT (0.54) PDE4BNAMPTKDM4EMAPTTHRB
SCHEMBL15157112 0.88 NAMPT (0.54) PDE4BNAMPTKDM4EMAPTTHRB
SCHEMBL19115170 0.87 PDE4B (0.63) PDE4BMEN1KMT2ASTSNAMPT
SCHEMBL24792692 0.85 NAMPT (0.52) PDE4BNAMPTQDPRKDM4EMAPT
SCHEMBL31130020 0.85 NAMPT (0.52) PDE4BKMT2ANAMPTKDM4EMAPT
SCHEMBL29751778 0.85 NAMPT (0.52) PDE4BNAMPTQDPRKDM4EMAPT
SCHEMBL30761541 0.85 PDE4B (0.56) PDE4BMEN1KMT2ASTSNAMPT
SCHEMBL3988015 0.84 DPP4 (0.52) PDE4BNAMPTKDM4EMAPTTHRB

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 4 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
US-20100105655-A1 NOVEL COMPOUNDS 515 ASTRAZENECA AB 2010-04-29 US 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 PDE4B 305/4885MEN1 3480/4885KMT2A 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.