SCHEMBL1607402

SCHEMBL1607402

Cc1cc(Nc2ncc(Cl)c(Nc3ccc(CNS(=O)(=O)C4CC4)cc3)n2)cc(C)c1OC(C)C

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 2/20 0.52
JAK1 P23458 2/20 0.52
FLT3 P36888 2/20 0.52
JAK3 P52333 2/20 0.52
TYK2 P29597 1/20 0.52
BRD4 O60885 7/20 0.47
EGFR P00533 2/20 0.44
NTRK1 P04629 2/20 0.44
PTK2 Q05397 5/20 0.43
ALK Q9UM73 6/20 0.42
INSR P06213 5/20 0.42
KCNH2 Q12809 2/20 0.42
PLK4 O00444 1/20 0.42
BUB1B O60566 1/20 0.42
ROCK2 O75116 1/20 0.42
ABL1 P00519 1/20 0.42
LCK P06239 1/20 0.42
NPM1 P06748 1/20 0.42
FES P07332 1/20 0.42
LYN P07948 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
SCHEMBL1607055 0.92 JAK1 (0.56) JAK2JAK1FLT3JAK3TYK2
SCHEMBL1606976 0.91 JAK2 (0.52) JAK2JAK1FLT3JAK3TYK2
SCHEMBL1606240 0.90 JAK2 (0.49) JAK2JAK1FLT3JAK3TYK2
SCHEMBL1607039 0.89 BRD4 (0.45) JAK2JAK1FLT3JAK3TYK2
SCHEMBL1606939 0.89 JAK2 (0.51) JAK2JAK1FLT3JAK3TYK2
SCHEMBL1606102 0.88 JAK2 (0.48) JAK2JAK1FLT3JAK3TYK2
SCHEMBL1606839 0.88 BRD4 (0.54) JAK2JAK1FLT3JAK3TYK2
SCHEMBL1606218 0.87 BRD4 (0.53) JAK2JAK1FLT3JAK3TYK2
SCHEMBL1607142 0.84 BRD4 (0.60) JAK2JAK1FLT3JAK3TYK2
SCHEMBL1606400 0.84 JAK2 (0.49) JAK2JAK1FLT3JAK3TYK2

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-8304422-B2 Compositions and methods for inhibition of the JAK pathway RIGEL PHARMACEUTICALS, INC. (US) 2012-11-06 US claimed
US-7947698-B2 Prevent trabsplant rejection; autoimmune diseases RIGEL PHARMACEUTICALS, INC. (US) 2011-05-24 US claimed
US-20110082146-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY RIGEL PHARMACEUTICALS, INC. (US) 2011-04-07 US claimed
US-20080279867-A1 Prevent trabsplant rejection; autoimmune diseases RIGEL PHARMACEUTICALS, INC. 2008-11-13 US claimed
WO-2008118822-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY RIGEL PHARMACEUTICALS, INC. (US) 2008-10-02 WO claimed
US-8304422-B2 Compositions and methods for inhibition of the JAK pathway RIGEL PHARMACEUTICALS, INC. (US) 2012-11-06 US disclosed
US-7947698-B2 Prevent trabsplant rejection; autoimmune diseases RIGEL PHARMACEUTICALS, INC. (US) 2011-05-24 US disclosed
US-20110082146-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY RIGEL PHARMACEUTICALS, INC. (US) 2011-04-07 US disclosed
US-20080279867-A1 Prevent trabsplant rejection; autoimmune diseases RIGEL PHARMACEUTICALS, INC. 2008-11-13 US disclosed
WO-2008118822-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY RIGEL PHARMACEUTICALS, INC. (US) 2008-10-02 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 (2 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-20110082146-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY JAK3, JAK2, JAK1 JAK2 2/4885JAK1 3/4885FLT3 46/4885
US-20080279867-A1 Prevent trabsplant rejection; autoimmune diseases JAK3, JAK1, JAK2 JAK2 3/4885JAK1 2/4885FLT3 775/4885

“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.