SCHEMBL12372600

SCHEMBL12372600

CC1(C)OCC(COc2cc(-c3cnc4c(n3)c(C(=O)C(C)(C)C)cn4COCC[Si](C)(C)C)cc(N3CCS(=O)(=O)CC3)c2)O1

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 2/20 0.33
NTRK1 P04629 2/20 0.33
DGAT1 O75907 2/20 0.31

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
SCHEMBL2276116 0.91 JAK2 (0.33) JAK2NTRK1DGAT1
SCHEMBL12372604 0.86 DGAT1 (0.34) JAK2DGAT1
SCHEMBL12372601 0.84 DGAT1 (0.32) JAK2DGAT1
SCHEMBL2277514 0.79 DGAT1 (0.35) DGAT1
SCHEMBL2273593 0.78 DGAT1 (0.33) DGAT1
SCHEMBL2272727 0.78 DGAT1 (0.35) DGAT1
SCHEMBL2276399 0.77 DGAT1 (0.33) DGAT1
SCHEMBL2280038 0.77 DGAT1 (0.33) DGAT1
SCHEMBL2276546 0.77 DGAT1 (0.33) DGAT1
SCHEMBL2274763 0.75 DGAT1 (0.33) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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

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 JAK2 4/4885NTRK1 2909/4885DGAT1 4740/4885

“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.