SCHEMBL13628829

SCHEMBL13628829

O=C(Cc1cccc(O)c1)N/N=C/c1c(Cl)ccc([N+](=O)[O-])c1Cl

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.50
MEN1 O00255 4/20 0.50
SGK1 O00141 1/20 0.48
LMNA P02545 5/20 0.47
NPC1 O15118 2/20 0.47
ALOX15 P16050 1/20 0.47
IDO1 P14902 2/20 0.46
MAPT P10636 4/20 0.43
ALDH1A1 P00352 3/20 0.43
KDM4E B2RXH2 2/20 0.43
POLB P06746 2/20 0.43
GAA P10253 1/20 0.43
HPGD P15428 1/20 0.43
RRM1 P23921 1/20 0.43
HTT P42858 2/20 0.43
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2C19 P33261 1/20 0.43
RAB9A P51151 2/20 0.42
L3MBTL1 Q9Y468 1/20 0.42

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
SCHEMBL13628746 0.87 KMT2A (0.58) KMT2AMEN1SGK1LMNAALOX15
SCHEMBL13628782 0.83 KMT2A (0.54) KMT2AMEN1SGK1LMNAALOX15
SCHEMBL13628724 0.82 LMNA (0.56) KMT2AMEN1SGK1LMNANPC1
SCHEMBL13628713 0.80 SGK1 (0.64) KMT2AMEN1SGK1LMNANPC1
SCHEMBL13628744 0.80 MAPT (0.62) KMT2AMEN1SGK1LMNANPC1
SCHEMBL13628754 0.78 LMNA (0.63) KMT2AMEN1SGK1LMNANPC1
SCHEMBL13628750 0.77 LMNA (0.67) KMT2AMEN1SGK1LMNANPC1
SCHEMBL13628774 0.77 SGK1 (0.53) KMT2AMEN1SGK1LMNANPC1
SCHEMBL13628735 0.77 LMNA (0.76) KMT2AMEN1SGK1LMNAMAPT
SCHEMBL13628784 0.77 KMT2A (0.54) KMT2AMEN1SGK1LMNAALOX15

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
US-7619115-B2 Ortho-substituted N'-benzylidene-(3-hydroxyphenyl)acethydrazides MERCK PATENT GMBH (DE) 2009-11-17 US disclosed
US-7619115-B2 Ortho-substituted N'-benzylidene-(3-hydroxyphenyl)acethydrazides MERCK PATENT GMBH (DE) 2009-11-17 US disclosed