SCHEMBL2883740

SCHEMBL2883740

O=c1[nH]nc(-c2ccncc2)c2[nH]c3ccccc3c12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 2/20 0.46
ATM Q13315 1/20 0.46
MAPK14 Q16539 2/20 0.46
CHEK1 O14757 3/20 0.45
GSK3A P49840 2/20 0.44
GSK3B P49841 2/20 0.44
MKNK1 Q9BUB5 1/20 0.43
ALDH1A1 P00352 4/20 0.43
KDM4E B2RXH2 3/20 0.43
NPC1 O15118 2/20 0.43
TP53 P04637 2/20 0.43
RAB9A P51151 2/20 0.43
CDK4 P11802 2/20 0.43
CCND1 P24385 2/20 0.43
PARP1 P09874 1/20 0.42
IMPDH2 P12268 1/20 0.42
HPGD P15428 3/20 0.41
GAA P10253 2/20 0.41
ALPL P05186 1/20 0.41
IDO1 P14902 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
SCHEMBL2886586 0.90 NPSR1 (0.58) NPSR1ATMCHEK1GSK3AGSK3B
SCHEMBL2886777 0.87 ATM (0.55) NPSR1ATMCHEK1GSK3AGSK3B
SCHEMBL2886287 0.85 IDO1 (0.59) NPSR1ATMCHEK1CDK4CCND1
SCHEMBL2880879 0.85 ATM (0.45) NPSR1ATMCHEK1GSK3AGSK3B
SCHEMBL2887042 0.82 DYRK1A (0.63) GSK3AGSK3BALDH1A1KDM4ENPC1
SCHEMBL2886307 0.80 LRRK2 (0.56) CHEK1ALDH1A1KDM4ENPC1RAB9A
SCHEMBL2887234 0.78 MAPT (0.54) NPSR1GSK3AGSK3BALDH1A1NPC1
SCHEMBL2891171 0.76 ADORA2A (0.53) CHEK1GSK3AGSK3BCDK4CCND1
SCHEMBL2882407 0.75 KDM4E (0.53) NPSR1CHEK1GSK3AGSK3BALDH1A1
SCHEMBL2889514 0.74 GSK3A (0.58) NPSR1ATMCHEK1GSK3AGSK3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2035429-B1 FUSED [d]PYRIDAZIN-7-ONES CEPHALON INC (US) 2012-09-19 EP disclosed
EP-2035429-B1 FUSED [d]PYRIDAZIN-7-ONES CEPHALON INC (US) 2012-09-19 EP disclosed
US-7732447-B2 such as 4-Pyridin-3-yl-2,5-dihydro-pyridazino[4,5-b]indol-1-one, used as inhibitors of vascular endothelial growth factor receptor (VEGFR) kinase, mixed lineage kinase (MLK) or cyclin-dependent kinase (CDK); treatment of angiogenic disorders and neurodegenerative diseases CEPHALON, INC. (US) 2010-06-08 US disclosed
US-7732447-B2 such as 4-Pyridin-3-yl-2,5-dihydro-pyridazino[4,5-b]indol-1-one, used as inhibitors of vascular endothelial growth factor receptor (VEGFR) kinase, mixed lineage kinase (MLK) or cyclin-dependent kinase (CDK); treatment of angiogenic disorders and neurodegenerative diseases CEPHALON, INC. (US) 2010-06-08 US disclosed
US-7732447-B2 such as 4-Pyridin-3-yl-2,5-dihydro-pyridazino[4,5-b]indol-1-one, used as inhibitors of vascular endothelial growth factor receptor (VEGFR) kinase, mixed lineage kinase (MLK) or cyclin-dependent kinase (CDK); treatment of angiogenic disorders and neurodegenerative diseases CEPHALON, INC. (US) 2010-06-08 US disclosed
US-20070299061-A1 Fused [d]pyridazin-7-ones CEPHALON, INC. (US) 2007-12-27 US disclosed
US-20070299061-A1 Fused [d]pyridazin-7-ones CEPHALON, INC. (US) 2007-12-27 US disclosed
US-20070299061-A1 Fused [d]pyridazin-7-ones CEPHALON, INC. (US) 2007-12-27 US disclosed
WO-2007149557-A1 FUSED [d]PYRIDAZIN-7-ONES CEPHALON, INC. (US) 2007-12-27 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-20070299061-A1 Fused [d]pyridazin-7-ones CDK5, CDK5R1, CDK7 NPSR1 3523/4885ATM 1480/4885MAPK14 489/4885

“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.