SCHEMBL4975504

SCHEMBL4975504

Cc1ccc(Nc2ncc(C)c(Nc3ccc(CNS(=O)(=O)c4cccnc4)cc3)n2)cc1S(N)(=O)=O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK3 P52333 13/20 0.51
JAK2 O60674 6/20 0.51
RET P07949 4/20 0.51
FLT3 P36888 4/20 0.51
ALK Q9UM73 4/20 0.51
SYK P43405 4/20 0.51
EGFR P00533 4/20 0.51
PLK4 O00444 3/20 0.51
AURKA O14965 3/20 0.51
DAPK3 O43293 3/20 0.51
PAK4 O96013 3/20 0.51
NTRK1 P04629 3/20 0.51
INSR P06213 3/20 0.51
LCK P06239 3/20 0.51
FYN P06241 3/20 0.51
CSF1R P07333 3/20 0.51
LYN P07948 3/20 0.51
ROS1 P08922 3/20 0.51
FGFR1 P11362 3/20 0.51
SRC P12931 3/20 0.51

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
SCHEMBL4971124 0.92 SYK (0.57) JAK3JAK2RETFLT3ALK
SCHEMBL4974627 0.91 JAK3 (0.62) JAK3JAK2RETFLT3ALK
SCHEMBL4975331 0.91 CA2 (0.55) JAK3JAK2RETFLT3ALK
SCHEMBL1115775 0.91 AURKA (0.49) JAK3JAK2RETFLT3ALK
SCHEMBL4973302 0.85 JAK3 (0.52) JAK3JAK2RETFLT3ALK
SCHEMBL4972449 0.83 JAK3 (0.50) JAK3JAK2RETFLT3ALK
SCHEMBL1476480 0.82 JAK3 (0.54) JAK3JAK2RETFLT3ALK
SCHEMBL4974169 0.82 JAK3 (0.54) JAK3JAK2RETFLT3ALK
SCHEMBL4976945 0.81 JAK3 (0.50) JAK3JAK2RETFLT3ALK
SCHEMBL4975727 0.80 JAK3 (0.56) JAK3JAK2RETFLT3ALK

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 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1991532-B1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY RIGEL PHARMACEUTICALS INC (US) 2017-01-11 EP claimed
US-8962643-B2 Compositions and methods for inhibition of the JAK pathway RIGEL PHARMACEUTICALS, INC. (US) 2015-02-24 US claimed
EP-1991532-A2 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY Rigel Pharmaceuticals, Inc. (US) 2008-11-19 EP claimed
WO-2007098507-A2 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY RIGEL PHARMACEUTICALS, INC. (US) 2007-08-30 WO claimed
US-20070203162-A1 Prevent transplant rejection; autoimmune diseases RIGEL PHARMACEUTICALS, INC. 2007-08-30 US claimed
EP-1991532-B1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY RIGEL PHARMACEUTICALS INC (US) 2017-01-11 EP disclosed
US-9481654-B2 Compositions and methods for inhibition of the JAK pathway RIGEL PHARMACEUTICALS, INC. (US) 2016-11-01 US disclosed
US-20150158824-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY RIGEL PHARMACEUTICALS, INC. (US) 2015-06-11 US disclosed
US-8962643-B2 Compositions and methods for inhibition of the JAK pathway RIGEL PHARMACEUTICALS, INC. (US) 2015-02-24 US disclosed
EP-1991532-A2 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY Rigel Pharmaceuticals, Inc. (US) 2008-11-19 EP disclosed
WO-2007098507-A2 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY RIGEL PHARMACEUTICALS, INC. (US) 2007-08-30 WO disclosed
US-20070203162-A1 Prevent transplant rejection; autoimmune diseases RIGEL PHARMACEUTICALS, INC. 2007-08-30 US 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-20070203162-A1 Prevent transplant rejection; autoimmune diseases JAK3, JAK1, JAK2 JAK3 1/4885JAK2 3/4885RET 1253/4885
US-20150158824-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY JAK3, JAK2, JAK1 JAK3 1/4885JAK2 2/4885RET 591/4885

“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.