SCHEMBL13723345

SCHEMBL13723345

Cc1cccc(-c2nc(N)ncc2C(N)=O)c1

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ADORA1 P30542 1/20 0.57
TLR8 Q9NR97 2/20 0.49
CDC7 O00311 4/20 0.47
RIPK2 O43353 1/20 0.47
PARP1 P09874 3/20 0.46
RAB9A P51151 1/20 0.45
CSNK1D P48730 1/20 0.42
CSNK1E P49674 1/20 0.42
MAPK14 Q16539 1/20 0.42
SYK P43405 5/20 0.42
DHODH Q02127 1/20 0.42
AURKB Q96GD4 2/20 0.41
ZAP70 P43403 1/20 0.41
KCNH2 Q12809 1/20 0.41

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
SCHEMBL14320333 0.85 NNMT (0.43) ADORA1CDC7PARP1SYK
SCHEMBL13723740 0.83 ADORA2A (0.60) ADORA1CDC7RIPK2PARP1RAB9A
SCHEMBL13723824 0.83 PARP1 (0.49) ADORA1CDC7PARP1SYK
SCHEMBL4560200 0.82 CDC7 (0.56) ADORA1CDC7PARP1
SCHEMBL18580116 0.75 TLR8 (0.51) TLR8CDC7RIPK2PARP1RAB9A
SCHEMBL1848248 0.75 SYK (0.43) TLR8SYKAURKBZAP70KCNH2
SCHEMBL13624692 0.75 SYK (0.67) SYKAURKBZAP70KCNH2
SCHEMBL1352415 0.75 SYK (0.60) SYKAURKBZAP70KCNH2
SCHEMBL1352413 0.75 SYK (0.60) SYKAURKBZAP70KCNH2
SCHEMBL1848253 0.75 SYK (0.57) SYKAURKBZAP70KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10752624-B2 Kinase inhibitors ORIGENIS GMBH (DE) 2020-08-25 US disclosed
US-20180305356-A1 NOVEL KINASE INHIBITORS ORIGENIS GMBH (DE) 2018-10-25 US disclosed
US-10000482-B2 Kinase inhibitors ORIGENIS GMBH (DE) 2018-06-19 US disclosed
US-9802937-B2 Substituted pyrazolo{4,3-D}pyrimidines as kinase inhibitors ORIGENIS GMBH (DE) 2017-10-31 US disclosed
US-9637491-B2 Pyrazolo[4,3-D]pyrimidines as kinase inhibitors ORIGENIS GMBH (DE) 2017-05-02 US disclosed
US-9499535-B2 Kinase inhibitors ORIGENIS GMBH (DE) 2016-11-22 US disclosed
EP-2699572-B1 HETEROCYCLIC COMPOUNDS AS KINASE INHIBITORS ORIGENIS GMBH (DE) 2016-08-10 EP disclosed
EP-2699579-B1 PYRAZOLO[4,3-D]PYRIMIDINES USEFUL AS KINASE INHIBITORS ORIGENIS GMBH (DE) 2015-10-07 EP disclosed
US-20150266882-A1 PYRAZOLO[4,3-D]PYRIMIDINES AS KINASE INHIBITORS ORIGENIS GMBH (DE) 2015-09-24 US disclosed
US-20150259340-A1 NOVEL KINASE INHIBITORS ORIGENIS GMBH (DE) 2015-09-17 US disclosed
WO-2014060112-A1 PYRAZOLO[4,3-D]PYRIMIDINES AS KINASE INHIBITORS ORIGENIS GMBH (DE) 2014-04-24 WO disclosed
WO-2014060113-A1 NOVEL KINASE INHIBITORS ORIGENIS GMBH (DE) 2014-04-24 WO disclosed
EP-2699579-A1 PYRAZOLO [4, 3-D]PYRIMIDINES USEFUL AS KINASE INHIBITORS Origenis GmbH (DE) 2014-02-26 EP disclosed
EP-2699572-A1 HETEROCYCLIC COMPOUNDS AS KINASE INHIBITORS Origenis GmbH (DE) 2014-02-26 EP disclosed
US-20120329780-A1 Novel kinase inhibitors ORIGENIS GMBH (DE) 2012-12-27 US disclosed
US-20120329785-A1 Novel kinase inhibitors ORIGENIS GMBH (DE) 2012-12-27 US disclosed
WO-2012143144-A1 PYRAZOLO [4, 3-D] PYRIMIDINES USEFUL AS KINASE INHIBITORS ORIGENIS GMBH (DE) 2012-10-26 WO disclosed
WO-2012143143-A1 HETEROCYCLIC COMPOUNDS AS KINASE INHIBITORS ORIGENIS GMBH (DE) 2012-10-26 WO 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 (7 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-20150259340-A1 NOVEL KINASE INHIBITORS LRRK2, MYLK2, MYLK ADORA1 3688/4885TLR8 1637/4885CDC7 1976/4885
US-20150266882-A1 PYRAZOLO[4,3-D]PYRIMIDINES AS KINASE INHIBITORS LRRK2, MYLK2, MYLK ADORA1 2322/4885TLR8 1588/4885CDC7 1717/4885
US-20180305356-A1 NOVEL KINASE INHIBITORS LRRK2, MYLK2, MYLK ADORA1 3688/4885TLR8 1637/4885CDC7 1976/4885
US-20120329780-A1 Novel kinase inhibitors LRRK2, MYLK2, MYLK ADORA1 3688/4885TLR8 1637/4885CDC7 1976/4885
US-20120329785-A1 Novel kinase inhibitors LRRK2, MYLK2, MYLK3 ADORA1 4468/4885TLR8 2418/4885CDC7 1311/4885
US-10000482-B2 Kinase inhibitors LRRK2, MYLK2, MYLK ADORA1 3607/4885TLR8 1490/4885CDC7 2000/4885
US-10752624-B2 Kinase inhibitors LRRK2, MYLK2, MYLK ADORA1 3607/4885TLR8 1490/4885CDC7 2000/4885

“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.