SCHEMBL6686826

SCHEMBL6686826

Cc1nn(-c2nnc3c4ccccc4n(C)c3n2)c(C)c1Cc1cccc(C(F)(F)F)c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.62
ALDH1A1 P00352 3/20 0.62
LMNA P02545 2/20 0.62
HTT P42858 2/20 0.62
HIF1A Q16665 1/20 0.62
NPC1 O15118 1/20 0.51
RAB9A P51151 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
MAPK1 P28482 2/20 0.49
NPSR1 Q6W5P4 2/20 0.49
POLB P06746 1/20 0.49
ALOX15 P16050 1/20 0.49
TSHR P16473 1/20 0.49
XBP1 P17861 1/20 0.49
KDM4E B2RXH2 1/20 0.37
GAA P10253 1/20 0.37
PRNP P04156 1/20 0.36
SSTR1 P30872 1/20 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
SCHEMBL6695812 0.90 MAPT (0.65) MAPTALDH1A1LMNAHTTHIF1A
SCHEMBL6696528 0.90 ALDH1A1 (0.64) MAPTALDH1A1LMNAHTTHIF1A
SCHEMBL6687006 0.89 LMNA (0.61) MAPTALDH1A1LMNAHTTHIF1A
SCHEMBL6688857 0.88 MAPT (0.65) MAPTALDH1A1LMNAHTTHIF1A
SCHEMBL6691112 0.88 MAPT (0.67) MAPTALDH1A1LMNAHTTHIF1A
SCHEMBL6689242 0.86 MAPT (0.65) MAPTALDH1A1LMNAHTTHIF1A
SCHEMBL6687406 0.85 MAPT (0.64) MAPTALDH1A1LMNAHTTHIF1A
SCHEMBL6691659 0.84 MAPT (0.67) MAPTALDH1A1LMNAHTTHIF1A
SCHEMBL6686783 0.81 MAPT (0.68) MAPTALDH1A1LMNAHTTHIF1A
SCHEMBL6694376 0.81 ALDH1A1 (0.58) MAPTALDH1A1LMNAHTTHIF1A

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 1 patent. 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 disclosed