SCHEMBL4153724

SCHEMBL4153724

NC(=O)c1cccc(-c2cncc(NCc3ccc(Cl)cc3)c2)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP4K4 O95819 1/20 0.49
SCN2A Q99250 1/20 0.48
SCN10A Q9Y5Y9 1/20 0.48
CLK1 P49759 1/20 0.47
FYN P06241 2/20 0.47
CNR1 P21554 3/20 0.46
VNN1 O95497 3/20 0.46
HDAC1 Q13547 2/20 0.45
HDAC8 Q9BY41 1/20 0.44
HDAC6 Q9UBN7 1/20 0.44
PPARA Q07869 1/20 0.43
NR4A2 P43354 1/20 0.43
RET P07949 1/20 0.43
CYP11B2 P19099 1/20 0.43
MKNK1 Q9BUB5 1/20 0.43
MKNK2 Q9HBH9 1/20 0.43
CCNT1 O60563 1/20 0.43
CCND1 P24385 1/20 0.43
CCNC P24863 1/20 0.43
CDK8 P49336 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
SCHEMBL4155314 0.90 VNN1 (0.55) MAP4K4SCN2ASCN10ACLK1FYN
SCHEMBL4155055 0.90 FYN (0.53) CLK1FYNCNR1VNN1HDAC1
SCHEMBL4155753 0.89 S1PR1 (0.46) CLK1FYNVNN1HDAC1HDAC8
SCHEMBL4156327 0.87 CLK1 (0.50) CLK1FYNVNN1HDAC1HDAC8
SCHEMBL4140370 0.86 CLK1 (0.48) CLK1FYNVNN1HDAC1HDAC8
SCHEMBL4148171 0.86 MAP4K4 (0.52) MAP4K4CLK1FYNVNN1HDAC1
SCHEMBL4140030 0.85 FYN (0.53) CLK1FYNVNN1HDAC1HDAC8
SCHEMBL4143243 0.84 FYN (0.57) CLK1FYNVNN1RETCYP11B2
SCHEMBL4143026 0.84 MKNK1 (0.50) CLK1FYNVNN1HDAC1MKNK1
SCHEMBL4199231 0.83 XDH (0.57) MAP4K4FYNCNR1NR4A2MKNK1

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090196912-A1 Pyridinylamines GPC BOTECH AG (DE) 2009-08-06 US claimed
EP-1789393-A2 PYRIDINYLAMINES GPC Biotech AG (DE) 2007-05-30 EP claimed
WO-2006010637-A2 PYRIDINYLAMINES GPC BIOTECH AG (DE) 2006-02-02 WO claimed
US-20200206188-A1 COMPOSITIONS AND METHODS TO IMPROVE THE THERAPEUTIC BENEFIT OF INDIRUBIN AND ANALOGS THEREOF, INCLUDING MEISOINDIGO BROWN DENNIS M (US) 2020-07-02 US disclosed
US-10383847-B2 Compositions and methods to improve the therapeutic benefit of indirubin and analogs thereof, including meisoindigo BROWN DENNIS M (US) 2019-08-20 US disclosed
US-20160243077-A1 COMPOSITIONS AND METHODS TO IMPROVE THE THERAPEUTIC BENEFIT OF INDIRUBIN AND ANALOGS THEREOF, INCLUDING MEISOINDIGO BROWN DENNIS M (US) 2016-08-25 US disclosed
US-20090196912-A1 Pyridinylamines GPC BOTECH AG (DE) 2009-08-06 US disclosed
US-20090163515-A1 Compounds Which Bind to the Active Site of Protein Kinase Enzymes BIOFOCUS DISCOVERY LTD. 2009-06-25 US disclosed
EP-1789393-A2 PYRIDINYLAMINES GPC Biotech AG (DE) 2007-05-30 EP disclosed
WO-2006010637-A2 PYRIDINYLAMINES GPC BIOTECH AG (DE) 2006-02-02 WO 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 (5 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-20090163515-A1 Compounds Which Bind to the Active Site of Protein Kinase Enzymes ROCK1, ROCK2, CIT MAP4K4 75/4885SCN2A 4701/4885SCN10A 3907/4885
US-10383847-B2 Compositions and methods to improve the therapeutic benefit of indirubin and analogs thereof, including meisoindigo NEK9, NEK7, NEK3 MAP4K4 546/4885SCN2A 3155/4885SCN10A 1389/4885
US-20200206188-A1 COMPOSITIONS AND METHODS TO IMPROVE THE THERAPEUTIC BENEFIT OF INDIRUBIN AND ANALOGS THEREOF, INCLUDING MEISOINDIGO NEK9, NEK7, NEK3 MAP4K4 546/4885SCN2A 3155/4885SCN10A 1389/4885
US-20160243077-A1 COMPOSITIONS AND METHODS TO IMPROVE THE THERAPEUTIC BENEFIT OF INDIRUBIN AND ANALOGS THEREOF, INCLUDING MEISOINDIGO NEK9, NEK7, NEK3 MAP4K4 546/4885SCN2A 3155/4885SCN10A 1389/4885
US-20090196912-A1 Pyridinylamines PRNP, PLPBP, SNCA MAP4K4 600/4885SCN2A 1548/4885SCN10A 993/4885

“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.