SCHEMBL5608261

SCHEMBL5608261

COCCN(CCOC)S(=O)(=O)c1ccc(Nc2nc3ncc(C#N)c(Nc4ccc(F)c(Cl)c4)c3s2)cc1

nearest known ligand 0.71

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
EGFR P00533 16/20 0.71
ERBB2 P04626 6/20 0.44
MAP3K8 P41279 4/20 0.43

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
SCHEMBL13480749 0.87 EGFR (0.54) EGFRERBB2MAP3K8
SCHEMBL13480747 0.85 EGFR (0.51) EGFRERBB2MAP3K8
SCHEMBL13672630 0.83 EGFR (1.00) EGFR
SCHEMBL13480746 0.79 EGFR (0.66) EGFRERBB2MAP3K8
SCHEMBL13480789 0.78 EGFR (0.54) EGFRERBB2MAP3K8
SCHEMBL13480765 0.78 EGFR (0.54) EGFRERBB2MAP3K8
SCHEMBL13480787 0.77 EGFR (0.50) EGFRERBB2MAP3K8
SCHEMBL13480784 0.76 EGFR (0.51) EGFRERBB2MAP3K8
SCHEMBL5608396 0.75 MAP3K8 (0.56) EGFRERBB2MAP3K8
SCHEMBL3192981 0.75 EGFR (0.67) EGFRMAP3K8

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7659284-B2 Inhibitors of ATP-protein kinase; 7-(3-chloro-4-fluoro-phenylamino)-2-(4-pyrrolidin-1-ylmethyl-phenylamino)-thiazolo[4,5-b]pyridine-6-carbonitrile JANSSEN PHARMACEUTICA NV (BE) 2010-02-09 US disclosed
US-7659284-B2 Inhibitors of ATP-protein kinase; 7-(3-chloro-4-fluoro-phenylamino)-2-(4-pyrrolidin-1-ylmethyl-phenylamino)-thiazolo[4,5-b]pyridine-6-carbonitrile JANSSEN PHARMACEUTICA NV (BE) 2010-02-09 US disclosed
EP-1789055-A2 THIAZOLOPYRIDINE KINASE INHIBITORS JANSSEN PHARMACEUTICA N.V. (BE) 2007-05-30 EP disclosed
WO-2006031929-A2 THIAZOLOPYRIDINE KINASE INHIBITORS JANSSEN PHARMACEUTICA, N.V. (BE) 2006-03-23 WO disclosed