SCHEMBL3195945

SCHEMBL3195945

C[S+]([O-])c1nc2ncc(C#N)c(Nc3ccc(F)c(Cl)c3)c2s1

nearest known ligand 0.50

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
EGFR P00533 7/20 0.50
ERBB2 P04626 2/20 0.50
MAP3K8 P41279 14/20 0.45
CYP3A4 P08684 1/20 0.45
MAPKAPK2 P49137 1/20 0.45

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
SCHEMBL3193466 0.82 EGFR (0.52) EGFRERBB2MAP3K8
SCHEMBL13480787 0.80 EGFR (0.50) EGFRERBB2MAP3K8CYP3A4MAPKAPK2
SCHEMBL13480784 0.78 EGFR (0.51) EGFRERBB2MAP3K8
SCHEMBL13480789 0.78 EGFR (0.54) EGFRERBB2MAP3K8
SCHEMBL13480746 0.77 EGFR (0.66) EGFRERBB2MAP3K8
SCHEMBL13480765 0.77 EGFR (0.54) EGFRERBB2MAP3K8
SCHEMBL3192981 0.74 EGFR (0.67) EGFRMAP3K8
SCHEMBL13480792 0.74 MAP3K8 (0.47) EGFRERBB2MAP3K8
SCHEMBL13480749 0.73 EGFR (0.54) EGFRERBB2MAP3K8
SCHEMBL5608261 0.73 EGFR (0.71) EGFRERBB2MAP3K8

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
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
US-20060058341-A1 Thiazolopyridine kinase inhibitors JANSSEN PHARMACEUTICA N.V. (BE) 2006-03-16 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 (1 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-20060058341-A1 Thiazolopyridine kinase inhibitors PRKACA, PRKCE, MAP3K9 EGFR 991/4885ERBB2 199/4885MAP3K8 33/4885

“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.