SCHEMBL1059335

SCHEMBL1059335

O=c1[nH]cnc2cc(Cl)nc(Nc3ccccc3)c12

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 5/20 0.44
PYGM P11217 1/20 0.42
JAK2 O60674 4/20 0.41
ZAP70 P43403 4/20 0.41
SYK P43405 4/20 0.41
LYN P07948 3/20 0.39
IP6K1 Q92551 1/20 0.39
KCNH2 Q12809 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
PDPK1 O15530 1/20 0.39
CA12 O43570 1/20 0.39
ALOX15 P16050 1/20 0.39
CA9 Q16790 1/20 0.39
TNKS2 Q9H2K2 1/20 0.39
ALDH1A1 P00352 1/20 0.38
NPC1 O15118 1/20 0.37
MAPT P10636 1/20 0.37
RAB9A P51151 1/20 0.37
RET P07949 1/20 0.37
FLT3 P36888 1/20 0.37

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
SCHEMBL1058856 0.85 LRRK2 (0.52) PARP1ZAP70SYKSMN1; SMN2ALDH1A1
SCHEMBL1058535 0.84 PARP1 (0.49) PARP1JAK2ZAP70MAPT
SCHEMBL1057076 0.84 JAK1 (0.41) PARP1JAK2SYK
SCHEMBL1057202 0.83 SYK (0.45) JAK2SYK
SCHEMBL1056394 0.80 CDK1 (0.49) JAK2SYKSMN1; SMN2NPC1MAPT
SCHEMBL1047700 0.80 SYK (0.57) JAK2ZAP70SYKSMN1; SMN2MAPT
SCHEMBL15760952 0.79 PARP1 (0.43) PARP1JAK2ZAP70SYKLYN
SCHEMBL24745795 0.79 TYK2 (0.41) PYGMZAP70SMN1; SMN2NPC1MAPT
SCHEMBL1059533 0.79 SYK (0.47) JAK2ZAP70SYKRETFLT3
SCHEMBL30497602 0.77 SYK (0.61) PARP1JAK2ZAP70SYKLYN

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-8354526-B2 Pyrido [4, 3-D] pyrimidinone derivatives as kinase inhibitors IRM LLC (BM) 2013-01-15 US claimed
US-20110003790-A1 PYRIDO [4, 3-D] PYRIMIDINONE DERIVATIVES AS KINASE INHIBITORS IRM LLC (BM) 2011-01-06 US claimed
EP-2250169-A1 PYRIDO [4, 3-D]PYRIMIDINONE DERIVATIVES AS KINASE INHIBITORS IRM LLC (BM) 2010-11-17 EP claimed
WO-2009099801-A1 PYRIDO [4, 3-D] PYRIMIDINONE DERIVATIVES AS KINASE INHIBITORS IRM LLC (BM) 2009-08-13 WO claimed
US-8354526-B2 Pyrido [4, 3-D] pyrimidinone derivatives as kinase inhibitors IRM LLC (BM) 2013-01-15 US disclosed
US-20110003790-A1 PYRIDO [4, 3-D] PYRIMIDINONE DERIVATIVES AS KINASE INHIBITORS IRM LLC (BM) 2011-01-06 US disclosed
EP-2250169-A1 PYRIDO [4, 3-D]PYRIMIDINONE DERIVATIVES AS KINASE INHIBITORS IRM LLC (BM) 2010-11-17 EP disclosed
WO-2009099801-A1 PYRIDO [4, 3-D] PYRIMIDINONE DERIVATIVES AS KINASE INHIBITORS IRM LLC (BM) 2009-08-13 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 (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-20110003790-A1 PYRIDO [4, 3-D] PYRIMIDINONE DERIVATIVES AS KINASE INHIBITORS ZAP70, FLT3, LCK PARP1 1016/4885PYGM 635/4885JAK2 58/4885

“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.