SCHEMBL5616533

SCHEMBL5616533

Cc1ccc(-c2cc(-c3ccc(F)cc3)nc(NN=Cc3ccccc3O)n2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.57
▸ NPC1 O15118 3/20 0.56
▸ RAB9A P51151 3/20 0.56
▸ MEN1 O00255 5/20 0.55
▸ KMT2A Q03164 5/20 0.55
▸ GAA P10253 4/20 0.55
▸ KDM4E B2RXH2 5/20 0.55
▸ HTT P42858 3/20 0.55
▸ POLB P06746 2/20 0.55
▸ BLM P54132 1/20 0.55
▸ TDP1 Q9NUW8 1/20 0.55
▸ DDX3X O00571 3/20 0.55
▸ GFER P55789 1/20 0.49
▸ SMN1; SMN2 Q16637 3/20 0.48
▸ ALDH1A1 P00352 2/20 0.48
▸ HPGD P15428 1/20 0.48
▸ LMNA P02545 4/20 0.47
▸ PLA2G1B P04054 1/20 0.47
▸ ATG4B Q9Y4P1 1/20 0.47
▸ RAD52 P43351 1/20 0.46

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
SCHEMBL5593306 0.92 MEN1 (0.65) MAPTNPC1RAB9AMEN1KMT2A
SCHEMBL5616531 0.89 MAPT (0.61) MAPTNPC1RAB9AMEN1KMT2A
SCHEMBL5592893 0.84 RAB9A (0.61) MAPTNPC1RAB9AMEN1KMT2A
SCHEMBL5593281 0.81 MAPT (0.58) MAPTNPC1RAB9AMEN1KMT2A
SCHEMBL5592835 0.80 RAB9A (0.61) MAPTNPC1RAB9AMEN1KMT2A
SCHEMBL5593146 0.80 KMT2A (0.55) MAPTNPC1RAB9AMEN1KMT2A
SCHEMBL5593021 0.78 MAPT (0.64) MAPTNPC1RAB9AMEN1KMT2A
SCHEMBL29839421 0.78 KMT2A (0.53) MAPTNPC1RAB9AMEN1KMT2A
SCHEMBL5665825 0.78 KMT2A (0.51) MAPTNPC1RAB9AMEN1KMT2A
SCHEMBL5592819 0.77 MEN1 (0.67) MAPTNPC1RAB9AMEN1KMT2A

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-2007074238-A2 NOVEL N-ALK-(E)-YLIDENE-N'-PYRIMIDIN-2-YL HYDRAZINE DERIVATIVES AND USE THEREOF AS CYTOPROTECTIVE DRUGS TROPHOS (FR) 2007-07-05 — — WO disclosed
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