SCHEMBL2316006

SCHEMBL2316006

CNC(C)C(=O)Nc1ccc(-c2ccccc2)n(Cc2cccc(Oc3ccc(F)cc3)c2)c1=O

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ELANE P08246 14/20 0.41
CTRC Q99895 2/20 0.41
BACE1 P56817 2/20 0.40
MMP13 P45452 1/20 0.40
PTGER3 P43115 1/20 0.39
DRD2 P14416 1/20 0.39

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
SCHEMBL2315997 1.00 ELANE (0.41) ELANECTRCBACE1MMP13PTGER3
SCHEMBL3850352 0.97 MMP13 (0.41) ELANECTRCBACE1MMP13PTGER3
SCHEMBL3850357 0.97 MMP13 (0.41) ELANECTRCBACE1MMP13PTGER3
SCHEMBL1328244 0.95 ELANE (0.43) ELANECTRCDRD2
SCHEMBL1328242 0.95 ELANE (0.43) ELANECTRCDRD2
SCHEMBL2319040 0.91 PTGER3 (0.41) ELANECTRCBACE1MMP13PTGER3
SCHEMBL2319046 0.91 PTGER3 (0.41) ELANECTRCBACE1MMP13PTGER3
SCHEMBL380513 0.89 ELANE (0.40) ELANECTRCBACE1
SCHEMBL381207 0.89 ELANE (0.40) ELANECTRCBACE1
SCHEMBL2314687 0.88 PTGER3 (0.41) ELANEBACE1MMP13PTGER3

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
US-7989441-B2 Organic compounds NOVARTIS AG (CH) 2011-08-02 US claimed
US-20090069294-A1 Organic Compounds NOVARTIS AG (CH) 2009-03-12 US claimed
EP-1902065-A2 CYCLIC AMIDE DERIVATIVES INHIBITORS OF THE INHIBITOR OF APOPTOSIS PROTEINS, THEIR PREPARATION, AND THEIR USE Novartis AG (CH) 2008-03-26 EP claimed
WO-2006133147-A2 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2006-12-14 WO claimed

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-20090069294-A1 Organic Compounds XIAP, BAX, MCL1 ELANE 2303/4885CTRC 4666/4885BACE1 248/4885

“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.