SCHEMBL13628767

SCHEMBL13628767

COc1cccc(F)c1/C=N/NC(=O)Cc1cccc(O)c1

nearest known ligand 0.68

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SGK1 O00141 1/20 0.68
ALOX15 P16050 1/20 0.49
MAPT P10636 4/20 0.47
KDM4E B2RXH2 3/20 0.47
POLB P06746 1/20 0.47
RXFP1 Q9HBX9 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
ALDH1A1 P00352 3/20 0.45
LMNA P02545 1/20 0.44
KMT2A Q03164 1/20 0.44
GAA P10253 2/20 0.44
GLA P06280 1/20 0.44
HDAC3 O15379 1/20 0.43
HDAC1 Q13547 1/20 0.43
HDAC2 Q92769 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
SCHEMBL13628769 0.89 SGK1 (0.59) SGK1ALOX15MAPTSMN1; SMN2ALDH1A1
SCHEMBL13628754 0.83 LMNA (0.63) SGK1ALOX15MAPTKDM4EPOLB
SCHEMBL13628785 0.83 SGK1 (0.56) SGK1ALOX15MAPTPOLBSMN1; SMN2
SCHEMBL14066181 0.83 SGK1 (0.71) SGK1ALOX15MAPTKDM4EPOLB
SCHEMBL13628783 0.82 SGK1 (0.64) SGK1ALOX15MAPTPOLBRXFP1
SCHEMBL13628768 0.82 SGK1 (0.64) SGK1MAPTKDM4EPOLBALDH1A1
SCHEMBL13628766 0.82 SGK1 (0.57) SGK1ALOX15MAPTSMN1; SMN2ALDH1A1
SCHEMBL13628786 0.81 SGK1 (0.54) SGK1ALOX15MAPTPOLBSMN1; SMN2
SCHEMBL13628770 0.81 SGK1 (0.59) SGK1ALOX15MAPTALDH1A1LMNA
SCHEMBL14066128 0.81 SGK1 (1.00) SGK1MAPTKDM4EPOLBRXFP1

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 SGK1 2/4885ALOX15 1650/4885MAPT 4540/4885

“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.