SCHEMBL2886777

SCHEMBL2886777

O=c1[nH]nc(-c2ccc(-c3ccccc3)cc2)c2[nH]c3ccccc3c12

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.55
NPSR1 Q6W5P4 1/20 0.55
KDM4E B2RXH2 4/20 0.51
ALDH1A1 P00352 3/20 0.51
NPC1 O15118 2/20 0.51
RAB9A P51151 2/20 0.51
TP53 P04637 1/20 0.51
GSK3A P49840 3/20 0.51
GSK3B P49841 3/20 0.51
HPGD P15428 2/20 0.50
IDO1 P14902 2/20 0.50
ALPL P05186 1/20 0.50
GAA P10253 1/20 0.50
TTK P33981 1/20 0.50
MAPK10 P53779 1/20 0.50
TDO2 P48775 2/20 0.49
HTR2B P41595 1/20 0.49
HTR5A P47898 1/20 0.49
TSHR P16473 1/20 0.48
HSD17B10 Q99714 1/20 0.48

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 0.97 NPSR1 (0.58) ATMNPSR1KDM4EALDH1A1NPC1
SCHEMBL2880879 0.89 ATM (0.45) ATMNPSR1KDM4EALDH1A1NPC1
SCHEMBL2883740 0.87 NPSR1 (0.46) ATMNPSR1KDM4EALDH1A1NPC1
SCHEMBL2887042 0.85 DYRK1A (0.63) KDM4EALDH1A1NPC1RAB9AGSK3A
SCHEMBL2886287 0.84 IDO1 (0.59) ATMNPSR1HPGDIDO1TTK
SCHEMBL2889514 0.78 GSK3A (0.58) ATMNPSR1KDM4EALDH1A1NPC1
SCHEMBL2884573 0.78 GSK3A (0.55) ATMNPSR1KDM4EALDH1A1NPC1
SCHEMBL2886307 0.78 LRRK2 (0.56) KDM4EALDH1A1NPC1RAB9AHPGD
SCHEMBL7698750 0.77 ALDH1A1 (0.61) ATMNPSR1KDM4EALDH1A1NPC1
SCHEMBL2879931 0.75 DYRK1A (0.78) NPSR1KDM4EALDH1A1NPC1RAB9A

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 ATM 1480/4885NPSR1 3523/4885KDM4E 1305/4885

“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.