SCHEMBL1607197

SCHEMBL1607197

N#Cc1ccc(Nc2ncc(F)c(Nc3ccc(CNS(=O)(=O)C4CC4)cc3)n2)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SYK P43405 13/20 0.64
JAK2 O60674 2/20 0.47
TYK2 P29597 2/20 0.47
FLT3 P36888 2/20 0.47
JAK3 P52333 2/20 0.47
JAK1 P23458 1/20 0.47
AURKA O14965 5/20 0.46
BTK Q06187 2/20 0.45
AURKB Q96GD4 2/20 0.43
GSK3A P49840 2/20 0.43
GSK3B P49841 2/20 0.43
PTK2 Q05397 2/20 0.43
PLK4 O00444 1/20 0.43
PDPK1 O15530 1/20 0.43
PRKD3 O94806 1/20 0.43
MAP4K4 O95819 1/20 0.43
NTRK1 P04629 1/20 0.43
INSR P06213 1/20 0.43
LCK P06239 1/20 0.43
FYN P06241 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
SCHEMBL1606649 0.91 SYK (0.64) SYKJAK2TYK2FLT3JAK3
SCHEMBL1607145 0.89 JAK1 (0.56) SYKJAK2TYK2FLT3JAK3
SCHEMBL1605866 0.87 SYK (0.46) SYKJAK2TYK2FLT3JAK3
SCHEMBL1606521 0.86 JAK2 (0.49) SYKJAK2TYK2FLT3JAK3
SCHEMBL1115754 0.86 JAK2 (0.49) SYKJAK2TYK2FLT3JAK3
SCHEMBL4971338 0.85 AURKA (0.55) SYKJAK2TYK2FLT3JAK3
SCHEMBL1115607 0.85 JAK2 (0.52) SYKJAK2TYK2FLT3JAK3
SCHEMBL1607527 0.84 AURKA (0.61) SYKJAK2TYK2FLT3JAK3
SCHEMBL4972312 0.83 JAK3 (0.49) SYKJAK2TYK2FLT3JAK3
SCHEMBL1606804 0.82 BCL6 (0.50) SYKJAK2TYK2FLT3JAK3

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 SYK 62/4885JAK2 2/4885TYK2 9/4885
US-20080279867-A1 Prevent trabsplant rejection; autoimmune diseases JAK3, JAK1, JAK2 SYK 130/4885JAK2 3/4885TYK2 21/4885

“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.