SCHEMBL1324439

SCHEMBL1324439

CN[C@@H](C)C(=O)Nc1ccc(-c2cccc(O)c2)n(Cc2cncc(C(=O)c3ccc(F)cc3)c2)c1=O

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ELANE P08246 16/20 0.39
GRIN1 Q05586 2/20 0.33
GRIN2B Q13224 2/20 0.33
ADORA2A P29274 1/20 0.33
ADORA2B P29275 1/20 0.33
ADORA1 P30542 1/20 0.33
PDE4B Q07343 1/20 0.33
CTRC Q99895 1/20 0.32
XIAP P98170 1/20 0.32

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
SCHEMBL1324460 1.00 ELANE (0.39) ELANEGRIN1GRIN2BADORA2AADORA2B
SCHEMBL12122043 1.00 ELANE (0.39) ELANEGRIN1GRIN2BADORA2AADORA2B
SCHEMBL12122072 0.94 GRIN1 (0.37) ELANEGRIN1GRIN2BXIAP
SCHEMBL1323845 0.94 GRIN1 (0.37) ELANEGRIN1GRIN2BXIAP
SCHEMBL1323841 0.94 GRIN1 (0.37) ELANEGRIN1GRIN2BXIAP
SCHEMBL1323936 0.92 GRIN1 (0.37) ELANEGRIN1GRIN2BCTRC
SCHEMBL1323939 0.92 GRIN1 (0.37) ELANEGRIN1GRIN2BCTRC
SCHEMBL12122044 0.92 GRIN1 (0.37) ELANEGRIN1GRIN2BCTRC
SCHEMBL381046 0.92 ELANE (0.40) ELANEXIAP
SCHEMBL381915 0.92 ELANE (0.40) ELANEXIAP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8058272-B2 Organic compounds NOVARTIS AG (CH) 2011-11-15 US claimed
US-20100048571-A1 Organic Compounds NOVARTIS AG 2010-02-25 US claimed
CN-101595093-A Organic compound NOVARTIS AG (CH) 2009-12-02 CN claimed
EP-2086938-A1 ORGANIC COMPOUNDS Novartis AG (CH) 2009-08-12 EP claimed
WO-2008073306-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2008-06-19 WO claimed
US-8058272-B2 Organic compounds NOVARTIS AG (CH) 2011-11-15 US disclosed
US-20100048571-A1 Organic Compounds NOVARTIS AG 2010-02-25 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-20100048571-A1 Organic Compounds XIAP, BAX, MCL1 ELANE 2481/4885GRIN1 2799/4885GRIN2B 3107/4885

“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.