SCHEMBL14645252

SCHEMBL14645252

C#CCO/N=C(/C)c1ccc(N2C(=O)N=NC2=O)cc1

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.37
PTBP1 P26599 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
CA9 Q16790 9/20 0.37
GAA P10253 1/20 0.36
MAPK1 P28482 1/20 0.36
HTT P42858 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
ALDH1A1 P00352 2/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA4 P22748 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
MAPT P10636 2/20 0.32
HPGD P15428 1/20 0.32
PPARA Q07869 3/20 0.32
PPARG P37231 2/20 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
SCHEMBL14645250 1.00 LMNA (0.37) LMNAPTBP1SMN1; SMN2CA9GAA
SCHEMBL14645253 1.00 LMNA (0.37) LMNAPTBP1SMN1; SMN2CA9GAA
SCHEMBL14645173 0.79 SMN1; SMN2 (0.37) LMNAPTBP1SMN1; SMN2CA9GAA
SCHEMBL14645172 0.79 SMN1; SMN2 (0.37) LMNAPTBP1SMN1; SMN2CA9GAA
SCHEMBL14645174 0.79 SMN1; SMN2 (0.37) LMNAPTBP1SMN1; SMN2CA9GAA
SCHEMBL12444966 0.79 PPARA (0.40) LMNAPTBP1SMN1; SMN2CA9GAA
SCHEMBL14645277 0.78 NPC1 (0.49) LMNASMN1; SMN2CA9GAAMAPK1
SCHEMBL14645275 0.78 NPC1 (0.49) LMNASMN1; SMN2CA9GAAMAPK1
SCHEMBL14645274 0.78 NPC1 (0.49) LMNASMN1; SMN2CA9GAAMAPK1
SCHEMBL15133950 0.76 PPARA (0.40) LMNAPTBP1SMN1; SMN2CA9GAA

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 LMNA 623/4885PTBP1 2846/4885SMN1; SMN2 1539/4885

“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.