SCHEMBL6689664

SCHEMBL6689664

Cc1nn(-c2nnc3c4ccccc4n(C)c3n2)c(C)c1Cc1ccccc1OCc1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.61
ALDH1A1 P00352 4/20 0.61
MAPT P10636 3/20 0.61
HTT P42858 2/20 0.61
HIF1A Q16665 1/20 0.61
MEN1 O00255 2/20 0.49
TSHR P16473 2/20 0.49
KMT2A Q03164 2/20 0.49
NPSR1 Q6W5P4 2/20 0.49
POLB P06746 1/20 0.49
ALOX15 P16050 1/20 0.49
XBP1 P17861 1/20 0.49
MAPK1 P28482 1/20 0.49
L3MBTL1 Q9Y468 2/20 0.48
NPC1 O15118 2/20 0.48
RAB9A P51151 2/20 0.48
ADORA1 P30542 2/20 0.38
ADORA3 P0DMS8 1/20 0.38
ADORA2A P29274 1/20 0.38
GAA P10253 2/20 0.36

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
SCHEMBL6687578 0.90 ALDH1A1 (0.63) LMNAALDH1A1MAPTHTTHIF1A
SCHEMBL6688796 0.88 MAPT (0.66) LMNAALDH1A1MAPTHTTHIF1A
SCHEMBL6694656 0.84 MAPT (0.71) LMNAALDH1A1MAPTHTTHIF1A
SCHEMBL6692642 0.82 MAPT (0.68) LMNAALDH1A1MAPTHTTHIF1A
SCHEMBL6691891 0.82 MAPT (0.68) LMNAALDH1A1MAPTHTTHIF1A
SCHEMBL6688574 0.81 SMN1; SMN2 (0.39) LMNAALDH1A1MAPTHTTHIF1A
SCHEMBL6686783 0.81 MAPT (0.68) LMNAALDH1A1MAPTHTTHIF1A
SCHEMBL6689242 0.80 MAPT (0.65) LMNAALDH1A1MAPTHTTHIF1A
SCHEMBL6691112 0.80 MAPT (0.67) LMNAALDH1A1MAPTHTTHIF1A
SCHEMBL6687406 0.79 MAPT (0.64) LMNAALDH1A1MAPTHTTHIF1A

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
WO-2004096808-A1 TRIAZINE COMPOUNDS AND THEIR USE DE NOVO PHARMACEUTICALS LIMITED (GB) 2004-11-11 WO claimed
WO-2004096808-A1 TRIAZINE COMPOUNDS AND THEIR USE DE NOVO PHARMACEUTICALS LIMITED (GB) 2004-11-11 WO disclosed