SCHEMBL1607288

SCHEMBL1607288

COc1ccc(Nc2ncc(Cl)c(Nc3ccc(CNS(=O)(=O)C4CC4)cc3)n2)cc1Cl

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 8/20 0.52
STK17B O94768 1/20 0.52
STK17A Q9UEE5 1/20 0.52
EGFR P00533 1/20 0.49
BCL6 P41182 5/20 0.48
FLT3 P36888 2/20 0.47
JAK2 O60674 1/20 0.47
JAK1 P23458 1/20 0.47
TYK2 P29597 1/20 0.47
JAK3 P52333 1/20 0.47
PTK2 Q05397 1/20 0.47
ALK Q9UM73 2/20 0.46
NCOR2 Q9Y618 1/20 0.45

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
SCHEMBL1606224 0.93 BRD4 (0.52) BRD4STK17BSTK17ABCL6FLT3
SCHEMBL1605451 0.92 BCL6 (0.59) STK17BSTK17AEGFRBCL6PTK2
SCHEMBL1606317 0.91 BRD4 (0.56) BRD4STK17AEGFRFLT3JAK2
SCHEMBL1607142 0.90 BRD4 (0.60) BRD4STK17AEGFRFLT3JAK2
SCHEMBL1606839 0.87 BRD4 (0.54) BRD4STK17AEGFRFLT3JAK2
SCHEMBL1606939 0.87 JAK2 (0.51) BRD4STK17AEGFRFLT3JAK2
SCHEMBL1606976 0.87 JAK2 (0.52) BRD4STK17AEGFRFLT3JAK2
SCHEMBL1606994 0.87 BRD4 (0.56) BRD4STK17AEGFRFLT3JAK2
SCHEMBL1606218 0.86 BRD4 (0.53) BRD4EGFRFLT3JAK2JAK1
SCHEMBL1607102 0.85 BRD4 (0.50) BRD4STK17BSTK17AEGFRBCL6

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 BRD4 538/4885STK17B 475/4885STK17A 220/4885
US-20080279867-A1 Prevent trabsplant rejection; autoimmune diseases JAK3, JAK1, JAK2 BRD4 2500/4885STK17B 916/4885STK17A 475/4885

“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.