SCHEMBL3143465

SCHEMBL3143465

CN(C)C(=O)C=Cc1nccc(-c2ccc(Oc3ccc(F)cc3)cc2)n1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
SCN4A P35499 4/20 0.46
SCN9A Q15858 11/20 0.42
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
MGLL Q99685 1/20 0.41
GAA P10253 1/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
ATM Q13315 1/20 0.39

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
SCHEMBL3138407 0.77 MAPT (0.52) MAPTL3MBTL1SCN4ASCN9AMEN1
SCHEMBL3140335 0.75 MAPT (0.60) MAPTL3MBTL1SCN4ASCN9AMEN1
SCHEMBL3143468 0.75 MAPT (0.46) MAPTL3MBTL1SCN4ASCN9AMEN1
SCHEMBL3133612 0.75 MAPT (0.55) MAPTL3MBTL1SCN4ASCN9AMEN1
SCHEMBL3128326 0.75 HSD11B1 (0.51) L3MBTL1SCN4ASCN9AMEN1KMT2A
Dimethylformamide SCHEMBL27566652 0.74 KMO (0.50) MAPTL3MBTL1SCN4ASCN9AMEN1
SCHEMBL3138716 0.73 MAPT (0.56) MAPTL3MBTL1SCN4ASCN9AMEN1
SCHEMBL3129059 0.73 MAPT (0.52) MAPTL3MBTL1SCN4ASCN9AMEN1
SCHEMBL3126799 0.71 KMO (0.60) MAPTL3MBTL1MEN1KMT2ANPC1
SCHEMBL27566662 0.71 NPC1 (0.51) MAPTL3MBTL1SCN4ASCN9AMEN1

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1265866-B1 ARYL SUBSTITUTED PYRIDINES, PYRIMIDINES, PYRAZINES AND TRIAZINES AND THE USE THEREOF EURO CELTIQUE SA (LU) 2010-07-21 EP disclosed
US-6867210-B2 Aryl substituted pyrimidines EURO-CELTIQUE S.A. (LU) 2005-03-15 US disclosed
US-20050043305-A1 Aryl substituted pyridines, pyrimidines, pyrazines and triazines and the use thereof EURO-CELTIQUE S.A. (LU) 2005-02-24 US disclosed
US-20040192691-A1 Aryl substituted pyridines, pyrimidines, pyrazines and triazines and the use thereof EURO-CELTIQUE S.A. 2004-09-30 US disclosed
EP-1265866-A2 ARYL SUBSTITUTED PYRIDINES, PYRIMIDINES, PYRAZINES AND TRIAZINES AND THE USE THEREOF Euro-Celtique S.A. (LU) 2002-12-18 EP disclosed
US-20020040025-A1 Aryl substituted pyridines, pyrimidines, pyrazines and triazines and the use thereof PURDUE PHARMA L.P. 2002-04-04 US disclosed
WO-2001068612-A2 ARYL SUBSTITUTED PYRIDINES, PYRIMIDINES, PYRAZINES AND TRIAZINES AND THE USE THEREOF EURO-CELTIQUE S.A. (LU) 2001-09-20 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 (3 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-20050043305-A1 Aryl substituted pyridines, pyrimidines, pyrazines and triazines and the use thereof CACNA1S, CACNA1C, KYNU MAPT 585/4885L3MBTL1 178/4885SCN4A 88/4885
US-20040192691-A1 Aryl substituted pyridines, pyrimidines, pyrazines and triazines and the use thereof CACNA1S, KYNU, CACNA1C MAPT 326/4885L3MBTL1 170/4885SCN4A 106/4885
US-20020040025-A1 Aryl substituted pyridines, pyrimidines, pyrazines and triazines and the use thereof CACNA1S, KYNU, CACNA1C MAPT 326/4885L3MBTL1 170/4885SCN4A 106/4885

“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.