SCHEMBL8239323

SCHEMBL8239323

Cc1ccc(C)c(Nc2nc(N/N=C/c3cc(Br)c(O)c(Br)c3O)nc(N3CCOCC3)n2)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 10/20 0.51
▸ KMT2A Q03164 6/20 0.51
▸ MEN1 O00255 4/20 0.51
▸ LMNA P02545 4/20 0.51
▸ NPSR1 Q6W5P4 2/20 0.51
▸ THRB P10828 1/20 0.51
▸ SMN1; SMN2 Q16637 3/20 0.51
▸ ALDH1A1 P00352 5/20 0.49
▸ CYP1A2 P05177 3/20 0.47
▸ CYP3A4 P08684 3/20 0.47
▸ CYP2C9 P11712 3/20 0.47
▸ CYP2C19 P33261 3/20 0.47
▸ HTT P42858 2/20 0.47
▸ CYP2D6 P10635 1/20 0.47
▸ KDM4E B2RXH2 2/20 0.47
▸ L3MBTL1 Q9Y468 1/20 0.45
▸ DDX3X O00571 1/20 0.44
▸ ATM Q13315 1/20 0.44
▸ GAA P10253 2/20 0.44
▸ PIKFYVE Q9Y2I7 1/20 0.44

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
SCHEMBL8238479 0.83 MAPT (0.61) MAPTKMT2AMEN1LMNANPSR1
SCHEMBL22737561 0.83 GBA1 (0.49) MAPTKMT2AMEN1LMNANPSR1
SCHEMBL22737771 0.80 KMT2A (0.57) MAPTKMT2AMEN1LMNANPSR1
SCHEMBL22737390 0.79 GBA1 (0.47) MAPTKMT2AMEN1LMNANPSR1
SCHEMBL14527861 0.79 DDX3X (0.60) MAPTKMT2AMEN1LMNANPSR1
SCHEMBL13943387 0.77 MAPT (0.60) MAPTKMT2AMEN1LMNANPSR1
SCHEMBL22737355 0.77 MAPT (0.57) MAPTKMT2AMEN1LMNANPSR1
SCHEMBL19016813 0.75 MAPT (0.61) MAPTKMT2AMEN1LMNASMN1; SMN2
SCHEMBL3059472 0.74 MAPK1 (0.60) MAPTKMT2AMEN1LMNANPSR1
SCHEMBL3059474 0.74 MAPK1 (0.60) MAPTKMT2AMEN1LMNANPSR1

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-2007051333-A1 TRIAZINE BETA-SECRETASE INHIBITORS ONCALIS AG (CH) 2007-05-10 — — WO disclosed
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