SCHEMBL8238479

SCHEMBL8238479

Cc1ccc(Nc2nc(N/N=C/c3cc(Br)cc(Br)c3O)nc(N3CCOCC3)n2)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 11/20 0.61
▸ KMT2A Q03164 8/20 0.61
▸ MEN1 O00255 6/20 0.61
▸ LMNA P02545 6/20 0.61
▸ NPSR1 Q6W5P4 4/20 0.61
▸ THRB P10828 1/20 0.61
▸ SMN1; SMN2 Q16637 3/20 0.60
▸ CYP1A2 P05177 3/20 0.55
▸ CYP3A4 P08684 3/20 0.55
▸ CYP2C9 P11712 3/20 0.55
▸ CYP2C19 P33261 3/20 0.55
▸ GAA P10253 4/20 0.51
▸ PIKFYVE Q9Y2I7 1/20 0.51
▸ ALDH1A1 P00352 5/20 0.50
▸ HTT P42858 3/20 0.48
▸ PKM P14618 1/20 0.48
▸ L3MBTL1 Q9Y468 1/20 0.48
▸ CYP2D6 P10635 1/20 0.48
▸ EGFR P00533 1/20 0.48
▸ KDM4E B2RXH2 2/20 0.47

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
SCHEMBL14527861 0.90 DDX3X (0.60) MAPTKMT2AMEN1LMNANPSR1
SCHEMBL8239323 0.83 MAPT (0.51) MAPTKMT2AMEN1LMNANPSR1
SCHEMBL19002884 0.79 MAPT (0.60) MAPTKMT2AMEN1LMNANPSR1
SCHEMBL23345459 0.78 KMT2A (0.72) MAPTKMT2AMEN1LMNANPSR1
SCHEMBL23345481 0.78 KMT2A (0.70) MAPTKMT2AMEN1LMNANPSR1
SCHEMBL12685994 0.77 MAPT (0.71) MAPTKMT2AMEN1LMNANPSR1
SCHEMBL8238853 0.77 DDX3X (0.61) MAPTKMT2AMEN1LMNANPSR1
SCHEMBL23345514 0.76 MAPT (0.71) MAPTKMT2AMEN1LMNANPSR1
SCHEMBL23345473 0.76 MAPT (0.71) MAPTKMT2AMEN1LMNANPSR1
SCHEMBL23345486 0.76 MAPT (0.69) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1790345-A1 Triazin beta-secretase inhibitors Esbatech AG (CH) 2007-05-30 — — EP disclosed
WO-2007051333-A1 TRIAZINE BETA-SECRETASE INHIBITORS ONCALIS AG (CH) 2007-05-10 — — WO disclosed
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