SCHEMBL14645174

SCHEMBL14645174

C#CCON=C(C)c1ccc(-n2c(=O)[nH][nH]c2=O)cc1

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.37
LMNA P02545 3/20 0.37
PTBP1 P26599 1/20 0.37
GAA P10253 1/20 0.36
GSK3A P49840 1/20 0.36
GSK3B P49841 1/20 0.36
L3MBTL1 Q9Y468 3/20 0.36
MAPK1 P28482 1/20 0.36
HTT P42858 1/20 0.36
CA9 Q16790 3/20 0.31
NPC1 O15118 3/20 0.31
RAB9A P51151 2/20 0.31
MAPT P10636 2/20 0.30
HPGD P15428 1/20 0.30
ALDH1A1 P00352 1/20 0.30
ALOX5 P09917 1/20 0.30

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
SCHEMBL14645172 1.00 SMN1; SMN2 (0.37) SMN1; SMN2LMNAPTBP1GAAGSK3A
SCHEMBL14645173 1.00 SMN1; SMN2 (0.37) SMN1; SMN2LMNAPTBP1GAAGSK3A
SCHEMBL16492677 0.81 SMN1; SMN2 (0.39) SMN1; SMN2LMNAPTBP1GAAGSK3A
SCHEMBL14645250 0.79 LMNA (0.37) SMN1; SMN2LMNAPTBP1GAAL3MBTL1
SCHEMBL14645252 0.79 LMNA (0.37) SMN1; SMN2LMNAPTBP1GAAL3MBTL1
SCHEMBL14645253 0.79 LMNA (0.37) SMN1; SMN2LMNAPTBP1GAAL3MBTL1
SCHEMBL12444962 0.79 PPARA (0.38) SMN1; SMN2LMNAPTBP1GAAGSK3A
SCHEMBL14645187 0.78 LMNA (0.50) SMN1; SMN2LMNAGAAGSK3AGSK3B
SCHEMBL14645185 0.78 LMNA (0.50) SMN1; SMN2LMNAGAAGSK3AGSK3B
SCHEMBL14645186 0.78 LMNA (0.50) SMN1; SMN2LMNAGAAGSK3AGSK3B

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-9149541-B2 Tyrosine ligation process NOVARTIS AG (CH) 2015-10-06 US disclosed
US-20140141034-A1 TYROSINE LIGATION PROCESS NOVARTIS AG (CH) 2014-05-22 US disclosed
EP-2729178-A1 TYROSINE LIGATION PROCESS Novartis AG (CH) 2014-05-14 EP disclosed
WO-2013009564-A1 TYROSINE LIGATION PROCESS NOVARTIS AG (CH) 2013-01-17 WO 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-20140141034-A1 TYROSINE LIGATION PROCESS ACP1, LTK, TTL SMN1; SMN2 1539/4885LMNA 623/4885PTBP1 2846/4885

“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.