SCHEMBL1324375

SCHEMBL1324375

CN[C@@H](C)C(=O)Nc1ccc(-c2ccncc2)n(Cc2cncc(C(=O)c3ccc(F)cc3)c2)c1=O

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ELANE P08246 5/20 0.37
GPR142 Q7Z601 1/20 0.36
NTRK1 P04629 3/20 0.36
LTA4H P09960 1/20 0.34
KMT2A Q03164 1/20 0.34
HSD17B10 Q99714 1/20 0.34
GSK3B P49841 1/20 0.34
FYN P06241 1/20 0.33
ROCK2 O75116 1/20 0.33
ENPP2 Q13822 1/20 0.33

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
SCHEMBL12122049 1.00 ELANE (0.37) ELANEGPR142NTRK1LTA4HKMT2A
SCHEMBL380277 0.96 ELANE (0.35) ELANENTRK1
SCHEMBL12122067 0.96 ELANE (0.35) ELANENTRK1
SCHEMBL380276 0.96 ELANE (0.35) ELANENTRK1
SCHEMBL381915 0.93 ELANE (0.40) ELANE
SCHEMBL381046 0.93 ELANE (0.40) ELANE
SCHEMBL1323856 0.92 ELANE (0.33) ELANEGPR142NTRK1
SCHEMBL12121987 0.92 ELANE (0.33) ELANEGPR142NTRK1
SCHEMBL1324444 0.92 MAPT (0.38) ELANENTRK1KMT2A
SCHEMBL12122004 0.92 HDAC6 (0.36) ELANE

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-8058272-B2 Organic compounds NOVARTIS AG (CH) 2011-11-15 US claimed
US-20100048571-A1 Organic Compounds NOVARTIS AG 2010-02-25 US 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 2481/4885GPR142 4350/4885NTRK1 4030/4885

“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.