SCHEMBL5593281

SCHEMBL5593281

Cc1ccc(-c2cc(-c3ccc(F)cc3)nc(NN=Cc3ccc(O)cc3)n2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 8/20 0.58
▸ MEN1 O00255 6/20 0.58
▸ KMT2A Q03164 6/20 0.58
▸ LMNA P02545 3/20 0.58
▸ MAPK1 P28482 1/20 0.58
▸ NPC1 O15118 3/20 0.51
▸ RAB9A P51151 3/20 0.51
▸ HTT P42858 4/20 0.51
▸ ALDH1A1 P00352 4/20 0.51
▸ KDM4E B2RXH2 3/20 0.51
▸ MCL1 Q07820 2/20 0.51
▸ HPGD P15428 2/20 0.48
▸ POLB P06746 2/20 0.48
▸ GAA P10253 2/20 0.47
▸ PKM P14618 2/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ NPSR1 Q6W5P4 1/20 0.44
▸ RAD52 P43351 1/20 0.43
▸ BLM P54132 1/20 0.43
▸ PAX8 Q06710 1/20 0.43

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
SCHEMBL5593141 0.94 MEN1 (0.61) MAPTMEN1KMT2ALMNAMAPK1
SCHEMBL5593144 0.94 MEN1 (0.61) MAPTMEN1KMT2ALMNAMAPK1
SCHEMBL5593073 0.89 RAB9A (0.65) MAPTMEN1KMT2ALMNAMAPK1
SCHEMBL5592827 0.89 MAPT (0.63) MAPTMEN1KMT2ALMNAMAPK1
SCHEMBL5593278 0.87 MAPT (0.61) MAPTMEN1KMT2ALMNAMAPK1
SCHEMBL5593050 0.86 RAB9A (0.55) MAPTMEN1KMT2ALMNAMAPK1
SCHEMBL5593046 0.86 RAB9A (0.55) MAPTMEN1KMT2ALMNAMAPK1
SCHEMBL5592821 0.82 MAPT (0.70) MAPTMEN1KMT2ALMNAMAPK1
SCHEMBL5616533 0.81 MAPT (0.57) MAPTMEN1KMT2ALMNANPC1
SCHEMBL5593177 0.81 MAPT (0.72) MAPTMEN1KMT2ALMNAMAPK1

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
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 claimed
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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