SCHEMBL2484874

SCHEMBL2484874

Cn1cc(-c2cnc3[nH]cc(C(=O)O)c3n2)cn1

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 6/20 0.56
SYK P43405 6/20 0.47
CHEK1 O14757 1/20 0.47
JAK3 P52333 5/20 0.45
JAK2 O60674 3/20 0.45
JAK1 P23458 3/20 0.45
CYP2C9 P11712 1/20 0.43
KCNH2 Q12809 1/20 0.41
CREBBP Q92793 1/20 0.41
PIK3CA P42336 1/20 0.40
MAPK8 P45983 1/20 0.40
MAPK9 P45984 1/20 0.40
MAPK10 P53779 1/20 0.40
STING1 Q86WV6 1/20 0.40

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
SCHEMBL2483997 0.84 MAPK1 (0.58) MAPK1SYKJAK3JAK2JAK1
SCHEMBL14655948 0.83 PAK1 (0.47) JAK3JAK2JAK1
SCHEMBL1368301 0.81 JAK2 (0.63) MAPK1SYKJAK3JAK2JAK1
SCHEMBL1696907 0.81 SYK (0.54) MAPK1SYKJAK3JAK2JAK1
SCHEMBL1369134 0.81 JAK2 (0.64) MAPK1SYKJAK3JAK2JAK1
SCHEMBL14655942 0.79 JAK3 (0.45) MAPK1SYKJAK3JAK2JAK1
SCHEMBL10071993 0.79 MAPK1 (0.60) MAPK1JAK3CREBBP
SCHEMBL1696797 0.79 MAPK1 (0.56) MAPK1SYKJAK3JAK2JAK1
SCHEMBL14655930 0.79 SYK (0.42) SYKJAK3JAK2JAK1CYP2C9
SCHEMBL14655935 0.78 SYK (0.40) MAPK1SYKJAK3JAK2JAK1

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140155376-A1 PYRROLOPYRAZINE KINASE INHIBITORS HOFFMANN-LA ROCHE INC. (US) 2014-06-05 US claimed
US-8518945-B2 Pyrrolopyrazine kinase inhibitors HOFFMANN-LA ROCHE INC. (US) 2013-08-27 US claimed
EP-2550273-A2 PYRROLOPYRAZINE KINASE INHIBITORS F. Hoffmann-La Roche AG (CH) 2013-01-30 EP claimed
WO-2011117145-A2 PYRROLOPYRAZINE KINASE INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2011-09-29 WO claimed
US-20140155376-A1 PYRROLOPYRAZINE KINASE INHIBITORS HOFFMANN-LA ROCHE INC. (US) 2014-06-05 US disclosed
US-8518945-B2 Pyrrolopyrazine kinase inhibitors HOFFMANN-LA ROCHE INC. (US) 2013-08-27 US disclosed
EP-2571880-A1 PYRROLO [2, 3 - B]PYRAZINE - 7 - CARBOXAMIDE DERIVATIVES AND THEIR USE AS JAK AND SYK INHIBITORS F.HOFFMANN-LA ROCHE AG (CH) 2013-03-27 EP disclosed
EP-2550273-A2 PYRROLOPYRAZINE KINASE INHIBITORS F. Hoffmann-La Roche AG (CH) 2013-01-30 EP 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-20140155376-A1 PYRROLOPYRAZINE KINASE INHIBITORS SYK, ZAP70, JAK2 MAPK1 438/4885SYK 1/4885CHEK1 1430/4885

“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.