SCHEMBL1607345

SCHEMBL1607345

Cc1nc2cc(Nc3ncc(Cl)c(Nc4ccc(CNS(=O)(=O)C5CC5)cc4)n3)ccc2[nH]1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 5/20 0.49
FLT3 P36888 5/20 0.46
JAK2 O60674 3/20 0.46
JAK3 P52333 3/20 0.46
JAK1 P23458 1/20 0.46
TYK2 P29597 1/20 0.46
ALK Q9UM73 8/20 0.43
PTK2 Q05397 3/20 0.43
AURKA O14965 2/20 0.43
DAPK3 O43293 2/20 0.43
PRKD3 O94806 2/20 0.43
MAP4K4 O95819 2/20 0.43
PAK4 O96013 2/20 0.43
NTRK1 P04629 2/20 0.43
LCK P06239 2/20 0.43
FYN P06241 2/20 0.43
CSF1R P07333 2/20 0.43
RET P07949 2/20 0.43
IGF1R P08069 2/20 0.43
MET P08581 2/20 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
SCHEMBL1607888 0.93 BRD4 (0.51) BRD4FLT3JAK2JAK3JAK1
SCHEMBL1607223 0.92 JAK1 (0.51) BRD4FLT3JAK2JAK3JAK1
SCHEMBL1606908 0.90 JAK3 (0.46) BRD4FLT3JAK2JAK3JAK1
SCHEMBL1607891 0.87 BRD4 (0.51) BRD4FLT3JAK2JAK3JAK1
SCHEMBL1606218 0.85 BRD4 (0.53) BRD4FLT3JAK2JAK3JAK1
SCHEMBL1607178 0.84 JAK1 (0.51) BRD4FLT3JAK2JAK3JAK1
SCHEMBL4972423 0.82 BRD4 (0.51) BRD4FLT3JAK2JAK3JAK1
SCHEMBL1608185 0.82 JAK1 (0.49) BRD4FLT3JAK2JAK3JAK1
SCHEMBL1606390 0.81 JAK1 (0.48) BRD4FLT3JAK2JAK3JAK1
SCHEMBL1607288 0.81 BRD4 (0.52) BRD4FLT3JAK2JAK3JAK1

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 538/4885FLT3 46/4885JAK2 2/4885
US-20080279867-A1 Prevent trabsplant rejection; autoimmune diseases JAK3, JAK1, JAK2 BRD4 2500/4885FLT3 775/4885JAK2 3/4885

“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.