SCHEMBL7578601

SCHEMBL7578601

Cc1c[nH]nc1-c1nccc(-c2ccc(Oc3ccc(F)cc3)cc2)n1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.48
L3MBTL1 Q9Y468 2/20 0.48
MEN1 O00255 6/20 0.47
KMT2A Q03164 6/20 0.47
GAA P10253 1/20 0.47
NPC1 O15118 3/20 0.45
RAB9A P51151 1/20 0.45
ATM Q13315 1/20 0.45
SCN4A P35499 4/20 0.44
SCN9A Q15858 2/20 0.39
ALDH1A1 P00352 2/20 0.38
PIK3CA P42336 1/20 0.38
PIK3CG P48736 1/20 0.38
MAPK14 Q16539 2/20 0.38
KDM4E B2RXH2 1/20 0.38
HPGD P15428 1/20 0.38
BRD4 O60885 1/20 0.38
BRDT Q58F21 1/20 0.38
CYP1A1 P04798 1/20 0.37
CYP1A2 P05177 1/20 0.37

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
SCHEMBL3125883 0.77 MAPT (0.58) MAPTL3MBTL1MEN1KMT2AGAA
SCHEMBL3143191 0.76 MAPT (0.52) MAPTL3MBTL1MEN1KMT2AGAA
SCHEMBL3138342 0.76 MAPT (0.52) MAPTL3MBTL1MEN1KMT2AGAA
SCHEMBL3128992 0.75 SCN4A (0.74) MAPTL3MBTL1MEN1KMT2AGAA
SCHEMBL3160320 0.73 MAPK14 (0.42) MEN1KMT2AGAANPC1RAB9A
SCHEMBL13363877 0.73 ERBB2 (0.39) MAPTMEN1KMT2AGAANPC1
SCHEMBL3138716 0.72 MAPT (0.56) MAPTL3MBTL1MEN1KMT2AGAA
SCHEMBL3131849 0.71 KMT2A (0.51) MAPTL3MBTL1MEN1KMT2AGAA
SCHEMBL3135386 0.71 MAPT (0.52) MAPTL3MBTL1MEN1KMT2AGAA
SCHEMBL28251671 0.71 NPC1 (0.74) MAPTL3MBTL1MEN1KMT2AGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1265866-A2 ARYL SUBSTITUTED PYRIDINES, PYRIMIDINES, PYRAZINES AND TRIAZINES AND THE USE THEREOF Euro-Celtique S.A. (LU) 2002-12-18 EP 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