SCHEMBL7353383

SCHEMBL7353383

CCCn1ncc(C(N)=O)c1NC(=O)c1ccccc1OCC

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.49
MAPK1 P28482 2/20 0.48
MAPT P10636 2/20 0.48
GAA P10253 2/20 0.48
ALOX15 P16050 1/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
HCRTR1 O43613 2/20 0.47
TP53 P04637 1/20 0.46
RXFP1 Q9HBX9 3/20 0.46
ALDH1A1 P00352 2/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
KCNK3 O14649 1/20 0.46
KCNK9 Q9NPC2 1/20 0.46
RAB9A P51151 1/20 0.46

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
SCHEMBL7446579 0.78 MAPK1 (0.48) LMNAMAPK1MAPTGAAALOX15
SCHEMBL3029893 0.75 MAPT (0.50) MAPK1MAPTGAAALOX15MEN1
SCHEMBL7167114 0.75 MAPT (0.60) LMNAMAPK1MAPTGAAALOX15
SCHEMBL7347313 0.74 NR3C1 (0.45) LMNAMAPTGAAMEN1KMT2A
SCHEMBL13087282 0.73 TSHR (0.38) ALDH1A1L3MBTL1
SCHEMBL7026143 0.73 MEN1 (0.44) LMNAMAPK1MAPTGAAALOX15
Ethenzamide SCHEMBL27612766 0.72 MAPT (0.68) LMNAMAPK1MAPTGAAMEN1
Ethenzamide SCHEMBL25624 0.72 MAPT (0.68) LMNAMAPK1MAPTGAAMEN1
SCHEMBL988 0.71 MAPT (0.50) LMNAMAPK1MAPTGAAALOX15
Ethenzamide SCHEMBL4379591 0.71 MAPT (0.66) LMNAMAPK1MAPTGAAMEN1

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
US-6200980-B1 ADMINISTERING PHENYL PURINONE COMPOUND FOR TREATING PRECANCEROUS LEISONS CELL PATHWAYS, INC. 2001-03-13 US disclosed
WO-1993007149-A1 PYRAZOLOPYRIMIDINONE ANTIANGINAL AGENTS PFIZER LIMITED (GB) 1993-04-15 WO disclosed