SCHEMBL4973116

SCHEMBL4973116

Cc1ccc(Nc2ncc(F)c(Nc3ccc(CNS(=O)(=O)C4CCCCC4)cc3)n2)cc1S(N)(=O)=O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SYK P43405 5/20 0.57
AURKA O14965 5/20 0.57
JAK3 P52333 4/20 0.57
JAK2 O60674 2/20 0.57
TYK2 P29597 2/20 0.57
FLT3 P36888 2/20 0.57
CDK2 P24941 2/20 0.57
EGFR P00533 2/20 0.57
AURKB Q96GD4 2/20 0.57
PLK4 O00444 1/20 0.57
PDPK1 O15530 1/20 0.57
DAPK3 O43293 1/20 0.57
MAP4K4 O95819 1/20 0.57
PAK4 O96013 1/20 0.57
CHEK2 O96017 1/20 0.57
ERBB2 P04626 1/20 0.57
NTRK1 P04629 1/20 0.57
PRKCG P05129 1/20 0.57
INSR P06213 1/20 0.57
LCK P06239 1/20 0.57

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
SCHEMBL4973502 0.99 SYK (0.57) SYKAURKAJAK3JAK2TYK2
SCHEMBL4976184 0.96 AURKA (0.59) SYKAURKAJAK3JAK2TYK2
SCHEMBL4972735 0.88 SYK (0.55) SYKAURKAJAK3JAK2TYK2
SCHEMBL4973704 0.88 AURKA (0.52) SYKAURKAJAK3JAK2TYK2
SCHEMBL4974169 0.88 JAK3 (0.54) SYKAURKAJAK3JAK2TYK2
SCHEMBL4975196 0.87 AURKA (0.53) SYKAURKAJAK3JAK2TYK2
SCHEMBL4975844 0.87 JAK3 (0.57) SYKAURKAJAK3JAK2TYK2
SCHEMBL4974490 0.86 JAK3 (0.58) SYKAURKAJAK3JAK2TYK2
SCHEMBL4972423 0.85 BRD4 (0.51) SYKAURKAJAK3JAK2TYK2
SCHEMBL4972183 0.85 SYK (0.63) SYKAURKAJAK3JAK2TYK2

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 SYK 233/4885AURKA 3449/4885JAK3 1/4885
US-20150158824-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY JAK3, JAK2, JAK1 SYK 62/4885AURKA 751/4885JAK3 1/4885

“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.