SCHEMBL2278142

SCHEMBL2278142

CC(C)(C)C(=O)c1c[nH]c2ncc(-c3cccc(CNS(C)(=O)=O)c3)nc12

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
JAK3 P52333 10/20 0.54
IGF1R P08069 1/20 0.42
MET P08581 1/20 0.42
SRC P12931 1/20 0.42
SYK P43405 3/20 0.41
CYP2D6 P10635 1/20 0.41
MAPK1 P28482 1/20 0.39
AURKA O14965 2/20 0.39
AURKB Q96GD4 2/20 0.39
BTK Q06187 1/20 0.39
ITK Q08881 1/20 0.39
IKBKB O14920 1/20 0.39
CHUK O15111 1/20 0.39
AAK1 Q2M2I8 1/20 0.39

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
SCHEMBL2275447 0.90 JAK3 (0.51) JAK3SYKCYP2D6MAPK1BTK
SCHEMBL2275344 0.89 JAK3 (0.51) JAK3SYKCYP2D6MAPK1BTK
SCHEMBL2280013 0.89 JAK3 (0.51) JAK3SYKCYP2D6BTKITK
SCHEMBL2282951 0.88 JAK3 (0.53) JAK3SYKCYP2D6MAPK1BTK
SCHEMBL2276633 0.86 JAK3 (0.58) JAK3SYKCYP2D6MAPK1
SCHEMBL1634076 0.86 JAK3 (0.58) JAK3SYKCYP2D6MAPK1
SCHEMBL2279840 0.85 JAK3 (0.58) JAK3SYKCYP2D6MAPK1
SCHEMBL2277530 0.84 JAK3 (0.57) JAK3SYKCYP2D6MAPK1
SCHEMBL13689482 0.84 JAK3 (0.57) JAK3SYKCYP2D6MAPK1
SCHEMBL2280913 0.83 JAK3 (0.59) JAK3SYKBTKITK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2245033-B1 PYRROLOPYRAZINE KINASE INHIBITORS HOFFMANN LA ROCHE (CH) 2011-08-31 EP claimed
US-8008298-B2 Pyrrolopyrazine kinase inhibitors Roche Palo Alto (US) 2011-08-30 US claimed
EP-2245033-A1 PYRROLOPYRAZINE KINASE INHIBITORS F. Hoffmann-La Roche AG (CH) 2010-11-03 EP claimed
US-20100267666-A1 Pyrrolopyrazine kinase inhibitors ROCHE PALO ALTO LLC 2010-10-21 US claimed
WO-2009106441-A1 PYRROLOPYRAZINE KINASE INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2009-09-03 WO claimed
US-8008298-B2 Pyrrolopyrazine kinase inhibitors Roche Palo Alto (US) 2011-08-30 US disclosed
US-8008298-B2 Pyrrolopyrazine kinase inhibitors Roche Palo Alto (US) 2011-08-30 US disclosed
US-8008298-B2 Pyrrolopyrazine kinase inhibitors Roche Palo Alto (US) 2011-08-30 US disclosed
US-20100267666-A1 Pyrrolopyrazine kinase inhibitors ROCHE PALO ALTO LLC 2010-10-21 US disclosed
US-20100267666-A1 Pyrrolopyrazine kinase inhibitors ROCHE PALO ALTO LLC 2010-10-21 US disclosed
US-20100267666-A1 Pyrrolopyrazine kinase inhibitors ROCHE PALO ALTO LLC 2010-10-21 US disclosed
WO-2009106441-A1 PYRROLOPYRAZINE KINASE INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2009-09-03 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 (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-20100267666-A1 Pyrrolopyrazine kinase inhibitors SYK, ZAP70, TYK2 JAK3 7/4885IGF1R 1487/4885MET 3853/4885

“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.