SCHEMBL1606649

SCHEMBL1606649

N#Cc1cccc(Nc2ncc(F)c(Nc3ccc(CNS(=O)(=O)C4CC4)cc3)n2)c1

nearest known ligand 0.64

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SYK P43405 11/20 0.64
BTK Q06187 2/20 0.53
EGFR P00533 2/20 0.53
CDC7 O00311 1/20 0.46
JAK1 P23458 2/20 0.46
JAK3 P52333 2/20 0.46
JAK2 O60674 1/20 0.44
TYK2 P29597 1/20 0.44
FLT3 P36888 1/20 0.44
AURKA O14965 1/20 0.44
BRD4 O60885 1/20 0.44
KDR P35968 1/20 0.44

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
SCHEMBL1607197 0.91 SYK (0.64) SYKBTKJAK1JAK3JAK2
SCHEMBL1606374 0.90 JAK3 (0.58) SYKBTKEGFRCDC7JAK1
SCHEMBL1605866 0.85 SYK (0.46) SYKEGFRJAK1JAK3JAK2
SCHEMBL1606521 0.85 JAK2 (0.49) SYKBTKEGFRJAK1JAK3
SCHEMBL4972992 0.85 JAK3 (0.60) SYKBTKEGFRCDC7JAK1
SCHEMBL1607120 0.84 AURKA (0.56) SYKEGFRJAK2AURKABRD4
SCHEMBL1607371 0.83 JAK1 (0.56) SYKBTKEGFRJAK1JAK3
SCHEMBL1115607 0.83 JAK2 (0.52) SYKBTKEGFRJAK1JAK3
SCHEMBL4971690 0.83 JAK1 (0.46) SYKEGFRJAK1JAK3JAK2
SCHEMBL4974490 0.82 JAK3 (0.58) SYKBTKEGFRCDC7JAK1

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 SYK 62/4885BTK 10/4885EGFR 529/4885
US-20080279867-A1 Prevent trabsplant rejection; autoimmune diseases JAK3, JAK1, JAK2 SYK 130/4885BTK 25/4885EGFR 1733/4885

“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.