SCHEMBL8241062

SCHEMBL8241062

O=C(O)c1cc(-c2ccc(/C=N/Nc3nc(Nc4ccccc4)nc(N4CCCCC4)n3)o2)ccc1Cl

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 16/20 0.56
▸ MEN1 O00255 13/20 0.56
▸ KMT2A Q03164 13/20 0.56
▸ GAA P10253 4/20 0.56
▸ NPSR1 Q6W5P4 4/20 0.56
▸ L3MBTL1 Q9Y468 3/20 0.56
▸ ALDH1A1 P00352 9/20 0.56
▸ KDM4E B2RXH2 5/20 0.56
▸ HPGD P15428 1/20 0.56
▸ ALOX12 P18054 1/20 0.56
▸ HTT P42858 3/20 0.55
▸ SMN1; SMN2 Q16637 2/20 0.55
▸ POLB P06746 4/20 0.54
▸ RECQL P46063 3/20 0.54
▸ TDP1 Q9NUW8 3/20 0.54
▸ PKM P14618 2/20 0.54
▸ CTDSP1 Q9GZU7 1/20 0.54
▸ CRHBP P24387 2/20 0.53
▸ CRHR2 Q13324 2/20 0.53
▸ MAPK1 P28482 1/20 0.53

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
SCHEMBL8239298 0.86 KMT2A (0.60) MAPTMEN1KMT2AGAANPSR1
SCHEMBL11913677 0.86 MAPT (0.65) MAPTMEN1KMT2AGAANPSR1
SCHEMBL8232030 0.85 MAPT (0.56) MAPTMEN1KMT2AGAANPSR1
SCHEMBL11918184 0.83 MAPT (0.65) MAPTMEN1KMT2AGAANPSR1
SCHEMBL12417187 0.83 MAPT (0.65) MAPTMEN1KMT2AGAANPSR1
SCHEMBL12417208 0.82 MAPT (0.59) MAPTMEN1KMT2AGAANPSR1
SCHEMBL12417175 0.80 MAPT (0.61) MAPTMEN1KMT2AGAANPSR1
SCHEMBL27776235 0.80 MAPT (0.63) MAPTMEN1KMT2AGAANPSR1
SCHEMBL6721154 0.79 CTSL (0.58) MAPTMEN1KMT2AGAANPSR1
SCHEMBL12717686 0.76 GAA (0.61) MAPTMEN1KMT2AGAANPSR1

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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