SCHEMBL1474824

SCHEMBL1474824

C#CCOc1ccc(Nc2nc(Nc3cccc(S(N)(=O)=O)c3)ncc2C)cc1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK3 P52333 15/20 0.74
SYK P43405 5/20 0.74
BTK Q06187 5/20 0.74
JAK2 O60674 5/20 0.74
EGFR P00533 5/20 0.74
ITK Q08881 4/20 0.74
PLK4 O00444 3/20 0.74
CHEK1 O14757 3/20 0.74
AURKA O14965 3/20 0.74
DCLK1 O15075 3/20 0.74
DAPK3 O43293 3/20 0.74
ROCK2 O75116 3/20 0.74
PAK4 O96013 3/20 0.74
ABL1 P00519 3/20 0.74
NTRK1 P04629 3/20 0.74
INSR P06213 3/20 0.74
LCK P06239 3/20 0.74
FYN P06241 3/20 0.74
LYN P07948 3/20 0.74
RET P07949 3/20 0.74

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
SCHEMBL4001373 0.91 JAK3 (0.81) JAK3SYKBTKJAK2EGFR
SCHEMBL1474685 0.90 CA2 (0.60) JAK3SYKBTKJAK2EGFR
SCHEMBL1474794 0.89 SYK (0.67) JAK3SYKBTKJAK2EGFR
SCHEMBL1475188 0.89 JAK3 (0.67) JAK3SYKBTKJAK2EGFR
SCHEMBL1474672 0.88 JAK3 (0.60) JAK3SYKBTKJAK2EGFR
SCHEMBL1607189 0.88 JAK3 (0.60) JAK3SYKBTKJAK2EGFR
SCHEMBL1474986 0.88 JAK3 (0.69) JAK3SYKBTKJAK2EGFR
SCHEMBL1474170 0.87 JAK3 (0.70) JAK3SYKBTKJAK2EGFR
SCHEMBL1476605 0.86 PTK2 (0.64) JAK3SYKBTKJAK2EGFR
SCHEMBL1474741 0.86 PTK2 (0.64) JAK3SYKBTKJAK2EGFR

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
US-9593082-B2 Compositions and methods for inhibition of the JAK pathway RIGEL PHARMACEUTICALS, INC. (US) 2017-03-14 US claimed
US-20080221089-A1 Prevent transplant rejection; autoimmune diseases RIGEL PHARMACEUTICALS, INC. 2008-09-11 US claimed
US-20070203161-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY RIGEL PHARMACEUTICALS, INC. 2007-08-30 US claimed
US-11667611-B2 Compositions and methods for inhibition of the JAK pathway RIGEL PHARMACEUTICALS, INC. (US) 2023-06-06 US disclosed
US-20190256476-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY RIGEL PHARMACEUTICALS, INC. (US) 2019-08-22 US disclosed
US-20170121291-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY RIGEL PHARMACEUTICALS, INC. (US) 2017-05-04 US disclosed
US-9593082-B2 Compositions and methods for inhibition of the JAK pathway RIGEL PHARMACEUTICALS, INC. (US) 2017-03-14 US disclosed
US-7915273-B2 Compositions and methods for inhibition of the JAK pathway RIGEL PHARMACEUTICALS, INC. (US) 2011-03-29 US disclosed
US-20100152218-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY RIGEL PHARMACEUTICALS, INC. (US) 2010-06-17 US disclosed
US-20080221089-A1 Prevent transplant rejection; autoimmune diseases RIGEL PHARMACEUTICALS, INC. 2008-09-11 US disclosed
WO-2008079907-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY RIGEL PHARMACEUTICALS, INC. (US) 2008-07-03 WO disclosed
US-20070203161-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY 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 (6 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-11667611-B2 Compositions and methods for inhibition of the JAK pathway JAK3, JAK2, JAK1 JAK3 1/4885SYK 62/4885BTK 10/4885
US-20170121291-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY JAK3, JAK2, JAK1 JAK3 1/4885SYK 62/4885BTK 10/4885
US-20190256476-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY JAK3, JAK2, JAK1 JAK3 1/4885SYK 62/4885BTK 10/4885
US-20070203161-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY JAK3, JAK2, JAK1 JAK3 1/4885SYK 62/4885BTK 10/4885
US-20080221089-A1 Prevent transplant rejection; autoimmune diseases JAK3, JAK1, JAK2 JAK3 1/4885SYK 233/4885BTK 50/4885
US-20100152218-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY JAK3, JAK2, JAK1 JAK3 1/4885SYK 62/4885BTK 10/4885

“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.