SCHEMBL2277867

SCHEMBL2277867

CSC1CCN(Cc2cccc(-c3cnc4[nH]cc(C(=O)C(C)(C)C)c4n3)c2)CC1

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
JAK3 P52333 9/20 0.51
CNR2 P34972 2/20 0.37
JAK2 O60674 2/20 0.37
SYK P43405 3/20 0.37
CYP2D6 P10635 2/20 0.37
FAAH O00519 1/20 0.37
JAK1 P23458 2/20 0.36
CNR1 P21554 1/20 0.36
WDR5 P61964 1/20 0.36
CHRM2 P08172 1/20 0.36
ACKR3 P25106 1/20 0.36
TYK2 P29597 1/20 0.36

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
SCHEMBL13689491 0.90 JAK3 (0.52) JAK3CNR2FAAHJAK1CHRM2
SCHEMBL2279247 0.89 JAK3 (0.51) JAK3CNR2SYKCYP2D6FAAH
SCHEMBL2277420 0.89 JAK3 (0.53) JAK3CNR2JAK2SYKCYP2D6
SCHEMBL2274049 0.88 JAK3 (0.52) JAK3CNR2JAK2CNR1WDR5
SCHEMBL2280094 0.88 JAK3 (0.52) JAK3CNR2SYKCYP2D6CNR1
SCHEMBL2280391 0.87 JAK3 (0.51) JAK3CNR2JAK2JAK1TYK2
SCHEMBL2279904 0.87 JAK3 (0.51) JAK3JAK2SYKCYP2D6JAK1
SCHEMBL2277369 0.87 JAK3 (0.51) JAK3CNR2JAK2SYKCYP2D6
SCHEMBL2279633 0.86 JAK3 (0.50) JAK3CNR2JAK2SYKCYP2D6
SCHEMBL2275248 0.86 JAK3 (0.50) JAK3JAK2JAK1TYK2

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 11 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
US-20100267666-A1 Pyrrolopyrazine kinase inhibitors ROCHE PALO ALTO LLC 2010-10-21 US claimed
EP-2245033-B1 PYRROLOPYRAZINE KINASE INHIBITORS HOFFMANN LA ROCHE (CH) 2011-08-31 EP 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-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 7/4885CNR2 2896/4885JAK2 4/4885

“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.