SCHEMBL2376498

SCHEMBL2376498

Cc1cc2nc(N)cnc2n1COCC[Si](C)(C)C

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.35
DGAT1 O75907 1/20 0.34
MAPT P10636 1/20 0.32
ALOX5AP P20292 2/20 0.32
FEN1 P39748 2/20 0.32
HTT P42858 1/20 0.30

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
SCHEMBL31533717 0.85 DGAT1 (0.41) NPC1DGAT1MAPTHTT
SCHEMBL2377093 0.85 DGAT1 (0.41) NPC1DGAT1MAPTHTT
SCHEMBL12389426 0.80 NPC1 (0.36) NPC1DGAT1MAPTHTT
SCHEMBL30867590 0.78 NPC1 (0.35) NPC1DGAT1MAPTALOX5APFEN1
SCHEMBL12389653 0.77 NPC1 (0.41) NPC1DGAT1MAPTALOX5APFEN1
SCHEMBL18210176 0.75 HTT (0.36) NPC1DGAT1MAPTHTT
SCHEMBL21463677 0.75 DGAT1 (0.39) NPC1DGAT1MAPTHTT
SCHEMBL2359261 0.75 DGAT1 (0.39) NPC1DGAT1MAPTALOX5APFEN1
SCHEMBL2376267 0.75 NPC1 (0.37) NPC1DGAT1MAPT
SCHEMBL1192594 0.74 DGAT1 (0.38) NPC1DGAT1MAPTHTT

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
EP-2373653-A1 PYRROLOPYRAZINYL UREA KINASE INHIBITORS F. Hoffmann-La Roche AG (CH) 2011-10-12 EP disclosed
US-8012974-B2 Pyrrolopyrazinyl urea kinase inhibitors ROCHE PALO ALTO LLC (US) 2011-09-06 US disclosed
WO-2010063634-A1 PYRROLOPYRAZINYL UREA KINASE INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2010-06-10 WO disclosed
US-20100144745-A1 Pyrrolopyrazinyl Urea Kinase Inhibitors ROCHE PALO ALTO LLC 2010-06-10 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-20100144745-A1 Pyrrolopyrazinyl Urea Kinase Inhibitors JAK1, JAK3, ULK3 NPC1 4394/4885DGAT1 4356/4885MAPT 2618/4885

“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.