SCHEMBL2377720

SCHEMBL2377720

CC(=O)N1CCC(NC(=O)Nc2cnc3c(ccn3COCC[Si](C)(C)C)n2)CC1

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 8/20 0.54
JAK3 P52333 7/20 0.43
EPHX2 P34913 8/20 0.38
EPHX1 P07099 1/20 0.38
JAK1 P23458 4/20 0.38
HPGDS O60760 1/20 0.37
HDAC4 P56524 1/20 0.35
WNT1 P04628 1/20 0.35
GSK3B P49841 1/20 0.35
DYRK1A Q13627 1/20 0.35

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
SCHEMBL2377266 0.97 JAK2 (0.51) JAK2JAK3EPHX2EPHX1JAK1
SCHEMBL2375949 0.95 JAK2 (0.50) JAK2JAK3EPHX2EPHX1JAK1
SCHEMBL2375958 0.95 JAK2 (0.50) JAK2JAK3EPHX2EPHX1JAK1
SCHEMBL2378005 0.95 JAK2 (0.50) JAK2JAK3EPHX2EPHX1JAK1
SCHEMBL2379481 0.92 JAK2 (0.45) JAK2JAK3EPHX2JAK1WNT1
SCHEMBL2378351 0.90 JAK2 (0.57) JAK2JAK3JAK1
SCHEMBL2376949 0.90 JAK2 (0.57) JAK2JAK3JAK1
SCHEMBL2376508 0.90 JAK2 (0.43) JAK2JAK3JAK1HPGDS
SCHEMBL2376961 0.90 JAK2 (0.57) JAK2JAK3JAK1
SCHEMBL2377659 0.90 JAK2 (0.48) JAK2JAK3JAK1

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 JAK2 5/4885JAK3 2/4885EPHX2 3904/4885

“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.