SCHEMBL2275367

SCHEMBL2275367

CC(C)(C)C(=O)c1cn(COCC[Si](C)(C)C)c2ncc(-c3cccc(N4CCN(C(=O)CO)CC4)c3)nc12

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 4/20 0.35
LCK P06239 3/20 0.35
HCK P08631 3/20 0.35
KDR P35968 3/20 0.35
SRC P12931 2/20 0.35
POLB P06746 3/20 0.34
ALDH1A1 P00352 2/20 0.34
TSHR P16473 3/20 0.34
MAPT P10636 7/20 0.33
HTT P42858 3/20 0.33
SMN1; SMN2 Q16637 3/20 0.33
NPSR1 Q6W5P4 1/20 0.33
LMNA P02545 2/20 0.33
TP53 P04637 2/20 0.33
GAA P10253 1/20 0.33
MAPK1 P28482 1/20 0.33
ALK Q9UM73 1/20 0.32

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
SCHEMBL2277427 0.92 DGAT1 (0.40) DGAT1ALDH1A1NPSR1ALK
SCHEMBL2277832 0.91 ADORA2A (0.41) MAPTMAPK1
SCHEMBL2272747 0.90 DGAT1 (0.38) DGAT1KDR
SCHEMBL2278452 0.89 DGAT1 (0.36) DGAT1
SCHEMBL2273709 0.89 DGAT1 (0.40) DGAT1
SCHEMBL2281494 0.89 PRKCI (0.40) DGAT1LCKHCKKDRSRC
SCHEMBL2278217 0.88 LCK (0.38) DGAT1LCKHCKPOLBALDH1A1
SCHEMBL2278197 0.88 DGAT1 (0.35) DGAT1SMN1; SMN2MAPK1
SCHEMBL2273028 0.87 DGAT1 (0.36) DGAT1
SCHEMBL2278153 0.86 JAK3 (0.35) DGAT1

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 5 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 disclosed
US-8008298-B2 Pyrrolopyrazine kinase inhibitors Roche Palo Alto (US) 2011-08-30 US disclosed
EP-2245033-A1 PYRROLOPYRAZINE KINASE INHIBITORS F. Hoffmann-La Roche AG (CH) 2010-11-03 EP 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 DGAT1 4740/4885LCK 9/4885HCK 314/4885

“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.