SCHEMBL1607349

SCHEMBL1607349

CCN1CCN(c2ccc(Nc3ncc(F)c(Nc4ccc(CNS(=O)(=O)C5CC5)cc4)n3)cc2C)CC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDGFRA P16234 4/20 0.47
PDGFRB P09619 3/20 0.47
EGFR P00533 3/20 0.47
JAK2 O60674 4/20 0.47
FLT3 P36888 4/20 0.47
JAK3 P52333 3/20 0.47
TYK2 P29597 2/20 0.47
JAK1 P23458 1/20 0.47
BRD4 O60885 8/20 0.46
ALK Q9UM73 3/20 0.46
WEE1 P30291 2/20 0.46
KDR P35968 3/20 0.45
AURKA O14965 3/20 0.45
AXL P30530 2/20 0.45
AURKB Q96GD4 2/20 0.45
DAPK3 O43293 2/20 0.45
PRKD3 O94806 2/20 0.45
MAP4K4 O95819 2/20 0.45
PAK4 O96013 2/20 0.45
LCK P06239 2/20 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
SCHEMBL1607283 0.93 PDGFRB (0.55) PDGFRAPDGFRBEGFRJAK2FLT3
SCHEMBL1606136 0.86 BRD4 (0.55) PDGFRAPDGFRBEGFRJAK2JAK3
SCHEMBL1607921 0.82 EGFR (0.54) EGFRJAK2FLT3JAK3TYK2
SCHEMBL1115607 0.82 JAK2 (0.52) EGFRJAK2FLT3JAK3TYK2
SCHEMBL1606521 0.81 JAK2 (0.49) EGFRJAK2FLT3JAK3TYK2
SCHEMBL1606965 0.81 JAK2 (0.52) EGFRJAK2FLT3JAK3TYK2
SCHEMBL4976184 0.81 AURKA (0.59) EGFRJAK2FLT3JAK3TYK2
SCHEMBL1607185 0.81 BRD4 (0.51) PDGFRAPDGFRBJAK2FLT3JAK3
SCHEMBL1606407 0.78 JAK2 (0.49) PDGFRAPDGFRBEGFRJAK2FLT3
SCHEMBL4973502 0.78 SYK (0.57) EGFRJAK2FLT3JAK3TYK2

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 PDGFRA 422/4885PDGFRB 322/4885EGFR 529/4885
US-20080279867-A1 Prevent trabsplant rejection; autoimmune diseases JAK3, JAK1, JAK2 PDGFRA 689/4885PDGFRB 504/4885EGFR 1733/4885

“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.