SCHEMBL1606253

SCHEMBL1606253

CCNS(=O)(=O)NCc1ccccc1Nc1nc(Nc2cc(C)c(OC)c(OC)c2)ncc1Cl

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 14/20 0.59
INSR P06213 13/20 0.59
CDK9 P50750 2/20 0.59
PTK2 Q05397 2/20 0.59
EGFR P00533 2/20 0.59
CDC7 O00311 1/20 0.59
PLK4 O00444 1/20 0.59
CHEK1 O14757 1/20 0.59
AURKA O14965 1/20 0.59
DCLK1 O15075 1/20 0.59
MAPK13 O15264 1/20 0.59
PDPK1 O15530 1/20 0.59
DYRK3 O43781 1/20 0.59
JAK2 O60674 1/20 0.59
ROCK2 O75116 1/20 0.59
RPS6KA5 O75582 1/20 0.59
PRKD3 O94806 1/20 0.59
MAP4K4 O95819 1/20 0.59
PAK4 O96013 1/20 0.59
CHEK2 O96017 1/20 0.59

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
SCHEMBL1607097 0.95 ALK (0.54) ALKINSRCDK9PTK2EGFR
SCHEMBL1607094 0.95 ALK (0.65) ALKINSRCDK9PTK2EGFR
SCHEMBL1606953 0.93 ALK (0.52) ALKINSRCDK9PTK2EGFR
SCHEMBL1606385 0.93 ALK (0.61) ALKINSRCDK9PTK2EGFR
SCHEMBL1608189 0.93 JAK2 (0.49) ALKINSRCDK9PTK2EGFR
SCHEMBL1606952 0.90 INSR (0.53) ALKINSRCDK9PTK2EGFR
SCHEMBL1607534 0.90 ALK (0.47) ALKINSRCDK9PTK2EGFR
SCHEMBL1606670 0.90 ALK (0.55) ALKINSRCDK9PTK2EGFR
SCHEMBL1606208 0.89 ALK (0.58) ALKINSRCDK9PTK2EGFR
SCHEMBL1606308 0.89 PTK2 (0.52) ALKINSRCDK9PTK2EGFR

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 ALK 557/4885INSR 2315/4885CDK9 106/4885
US-20080279867-A1 Prevent trabsplant rejection; autoimmune diseases JAK3, JAK1, JAK2 ALK 707/4885INSR 1103/4885CDK9 686/4885

“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.