SCHEMBL1605451

SCHEMBL1605451

COc1ccc(Nc2ncc(F)c(Nc3ccc(CNS(=O)(=O)C4CC4)cc3)n2)cc1Cl

nearest known ligand 0.59

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
BCL6 P41182 12/20 0.59
NCOR2 Q9Y618 2/20 0.56
SYK P43405 4/20 0.54
STK17B O94768 1/20 0.48
STK17A Q9UEE5 1/20 0.48
PTK2 Q05397 1/20 0.47
EGFR P00533 2/20 0.46
AURKA O14965 1/20 0.46

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
SCHEMBL1607288 0.92 BRD4 (0.52) BCL6NCOR2STK17BSTK17APTK2
SCHEMBL1606875 0.91 BCL6 (0.48) BCL6NCOR2SYKSTK17BSTK17A
SCHEMBL1606224 0.91 BRD4 (0.52) BCL6STK17BSTK17APTK2
SCHEMBL1606993 0.88 SYK (0.52) SYKSTK17BSTK17APTK2EGFR
SCHEMBL1606407 0.85 JAK2 (0.49) SYKSTK17BSTK17APTK2EGFR
SCHEMBL1605866 0.85 SYK (0.46) BCL6SYKEGFRAURKA
SCHEMBL1606521 0.85 JAK2 (0.49) SYKSTK17APTK2EGFRAURKA
SCHEMBL1606965 0.84 JAK2 (0.52) SYKSTK17AEGFRAURKA
SCHEMBL1115607 0.84 JAK2 (0.52) SYKSTK17APTK2EGFRAURKA
SCHEMBL1607102 0.83 BRD4 (0.50) BCL6SYKSTK17BSTK17AEGFR

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 BCL6 245/4885NCOR2 3241/4885SYK 62/4885
US-20080279867-A1 Prevent trabsplant rejection; autoimmune diseases JAK3, JAK1, JAK2 BCL6 451/4885NCOR2 3211/4885SYK 130/4885

“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.