SCHEMBL4559372

SCHEMBL4559372

O=C(Cc1cccc(O)c1)N/N=C\c1ccccc1

nearest known ligand 0.68

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.68
MEN1 O00255 5/20 0.63
KMT2A Q03164 5/20 0.63
POLB P06746 2/20 0.63
SGK1 O00141 1/20 0.61
LMNA P02545 3/20 0.60
NPC1 O15118 2/20 0.60
GFER P55789 1/20 0.56
SMN1; SMN2 Q16637 2/20 0.54
KDM4E B2RXH2 1/20 0.54
RAB9A P51151 1/20 0.54
G6PD P11413 1/20 0.52
CYP1A2 P05177 1/20 0.52
CYP2C9 P11712 1/20 0.52
CYP2C19 P33261 1/20 0.52
CTDSP1 Q9GZU7 1/20 0.52
TDP1 Q9NUW8 1/20 0.52

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
SCHEMBL4559373 1.00 ALDH1A1 (0.68) ALDH1A1MEN1KMT2APOLBSGK1
SCHEMBL1578929 0.87 MEN1 (0.80) MEN1KMT2APOLBLMNANPC1
SCHEMBL1578931 0.87 MEN1 (0.80) MEN1KMT2APOLBLMNANPC1
SCHEMBL13628743 0.83 SGK1 (0.61) ALDH1A1MEN1KMT2ASGK1LMNA
SCHEMBL13628763 0.82 SGK1 (0.63) ALDH1A1MEN1KMT2ASGK1LMNA
SCHEMBL13628702 0.82 SGK1 (0.63) ALDH1A1MEN1KMT2APOLBSGK1
SCHEMBL13628735 0.82 LMNA (0.76) ALDH1A1MEN1KMT2ASGK1LMNA
SCHEMBL24355615 0.81 ALDH1A1 (1.00) ALDH1A1MEN1KMT2APOLBLMNA
SCHEMBL13628769 0.81 SGK1 (0.59) ALDH1A1MEN1KMT2ASGK1LMNA
SCHEMBL13628770 0.81 SGK1 (0.59) ALDH1A1MEN1KMT2ASGK1LMNA

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 4 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
US-20080032983-A1 Such as N'-[1-(2-ethyl-4,6-dihydroxyphenyl)meth-(E)-ylidene]-(3-hydroxyphenyl)acetohydrazide which are serum glucocoriticoid kinase inhibitors; diabetes, obesity, metabolic syndrome (dyslipidaemia), systemic and pulmonary hypertonia, cardiovascular and kidney diseases, fibrosis and inflammation MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2008-02-07 US disclosed
US-20080032983-A1 Such as N'-[1-(2-ethyl-4,6-dihydroxyphenyl)meth-(E)-ylidene]-(3-hydroxyphenyl)acetohydrazide which are serum glucocoriticoid kinase inhibitors; diabetes, obesity, metabolic syndrome (dyslipidaemia), systemic and pulmonary hypertonia, cardiovascular and kidney diseases, fibrosis and inflammation MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2008-02-07 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080032983-A1 Such as N'-[1-(2-ethyl-4,6-dihydroxyphenyl)meth-(E)-ylidene]-(3-hydroxyphenyl)acetohydrazide which are serum glucocoriticoid kinase inhibitors; diabetes, obesity, metabolic syndrome (dyslipidaemia), systemic and pulmonary hypertonia, cardiovascular and kidney diseases, fibrosis and inflammation GRK4, SGK1, SGK2 ALDH1A1 2555/4885MEN1 3671/4885KMT2A 3022/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.