SCHEMBL1323918

SCHEMBL1323918

CNC(C)C(=O)Nc1ccc(-c2cccc(C(=O)NCC(C)C)c2)n(Cc2cncc(C(=O)c3ccc(F)cc3)c2)c1=O

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.36
ELANE P08246 6/20 0.35
GAA P10253 1/20 0.35
KMT2A Q03164 1/20 0.35
HSD17B10 Q99714 1/20 0.35
LMNA P02545 1/20 0.34
XIAP P98170 3/20 0.33
BIRC3 Q13489 2/20 0.33
ABL1 P00519 1/20 0.33
BCR P11274 1/20 0.33
NAMPT P43490 1/20 0.33
PRKAA2 P54646 1/20 0.33
AURKA O14965 1/20 0.33
BRD4 O60885 1/20 0.32
RAD52 P43351 1/20 0.32
HTT P42858 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
SCHEMBL1323915 1.00 POLB (0.36) POLBELANEGAAKMT2AHSD17B10
SCHEMBL12121991 1.00 POLB (0.36) POLBELANEGAAKMT2AHSD17B10
SCHEMBL1323932 0.93 ELANE (0.35) ELANEABL1BCR
SCHEMBL12122045 0.93 ELANE (0.35) ELANEABL1BCR
SCHEMBL1323934 0.93 ELANE (0.35) ELANEABL1BCR
SCHEMBL12122062 0.92 FYN (0.36) ELANEABL1BCRRAD52
SCHEMBL1322208 0.92 FYN (0.36) ELANEABL1BCRRAD52
SCHEMBL1322211 0.92 FYN (0.36) ELANEABL1BCRRAD52
SCHEMBL1323845 0.90 GRIN1 (0.37) ELANELMNAXIAP
SCHEMBL12122072 0.90 GRIN1 (0.37) ELANELMNAXIAP

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 5 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
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 POLB 545/4885ELANE 2481/4885GAA 1794/4885

“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.