SCHEMBL14645274

SCHEMBL14645274

C/C(=N\OCc1ccccc1)c1ccc(N2C(=O)N=NC2=O)cc1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.49
RAB9A P51151 3/20 0.49
L3MBTL1 Q9Y468 3/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
S1PR1 P21453 6/20 0.46
GAA P10253 1/20 0.45
LMNA P02545 3/20 0.45
MAPK1 P28482 1/20 0.44
HTT P42858 1/20 0.44
PPARG P37231 2/20 0.43
PPARA Q07869 2/20 0.43
HPGD P15428 1/20 0.42
CA9 Q16790 1/20 0.42
POLB P06746 1/20 0.40

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
SCHEMBL14645277 1.00 NPC1 (0.49) NPC1RAB9AL3MBTL1SMN1; SMN2S1PR1
SCHEMBL14645275 1.00 NPC1 (0.49) NPC1RAB9AL3MBTL1SMN1; SMN2S1PR1
SCHEMBL14645185 0.80 LMNA (0.50) NPC1RAB9AL3MBTL1SMN1; SMN2S1PR1
SCHEMBL14645186 0.80 LMNA (0.50) NPC1RAB9AL3MBTL1SMN1; SMN2S1PR1
SCHEMBL14645187 0.80 LMNA (0.50) NPC1RAB9AL3MBTL1SMN1; SMN2S1PR1
SCHEMBL4451421 0.79 L3MBTL1 (0.71) NPC1RAB9AL3MBTL1SMN1; SMN2S1PR1
SCHEMBL19733323 0.79 L3MBTL1 (0.71) NPC1RAB9AL3MBTL1SMN1; SMN2S1PR1
SCHEMBL14645252 0.78 LMNA (0.37) L3MBTL1SMN1; SMN2GAALMNAMAPK1
SCHEMBL14645250 0.78 LMNA (0.37) L3MBTL1SMN1; SMN2GAALMNAMAPK1
SCHEMBL14645253 0.78 LMNA (0.37) L3MBTL1SMN1; SMN2GAALMNAMAPK1

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 9 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-9149541-B2 Tyrosine ligation process NOVARTIS AG (CH) 2015-10-06 US disclosed
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
US-20140141034-A1 TYROSINE LIGATION PROCESS NOVARTIS AG (CH) 2014-05-22 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
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 NPC1 4608/4885RAB9A 2730/4885L3MBTL1 312/4885

“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.