SCHEMBL2377080

SCHEMBL2377080

C[Si](C)(C)CCOCn1ccc2nc(NC(=O)NC3CCCNC3)cnc21

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 11/20 0.40
JAK3 P52333 10/20 0.40
JAK1 P23458 7/20 0.40
POLQ O75417 1/20 0.39
MAPK1 P28482 2/20 0.36
GUCY1B2 O75343 1/20 0.36
GUCY1A2 P33402 1/20 0.36
GUCY1A1 Q02108 1/20 0.36
GUCY1B1 Q02153 1/20 0.36
FLT3 P36888 2/20 0.35
HDAC4 P56524 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
Hydrochloric Acid SCHEMBL2377061 0.99 JAK2 (0.40) JAK2JAK3JAK1POLQMAPK1
Hydrochloric Acid SCHEMBL2377608 0.99 JAK2 (0.40) JAK2JAK3JAK1POLQMAPK1
Hydrochloric Acid SCHEMBL2377059 0.99 JAK2 (0.40) JAK2JAK3JAK1POLQMAPK1
Hydrochloric Acid SCHEMBL2376826 0.97 JAK2 (0.41) JAK2JAK3JAK1POLQMAPK1
SCHEMBL2375977 0.95 MAPK1 (0.40) JAK2JAK3JAK1POLQMAPK1
SCHEMBL2375974 0.95 MAPK1 (0.40) JAK2JAK3JAK1POLQMAPK1
Hydrochloric Acid SCHEMBL2377071 0.94 MAPK1 (0.40) JAK2JAK3JAK1POLQMAPK1
Hydrochloric Acid SCHEMBL2378174 0.94 MAPK1 (0.40) JAK2JAK3JAK1POLQMAPK1
Hydrochloric Acid SCHEMBL2379066 0.94 MAPK1 (0.40) JAK2JAK3JAK1POLQMAPK1
Hydrochloric Acid SCHEMBL2377062 0.94 MAPK1 (0.40) JAK2JAK3JAK1POLQMAPK1

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 2/4885JAK1 1/4885

“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.