SCHEMBL2886713

SCHEMBL2886713

Cn1c2ccccc2c2c(=O)[nH]nc(-c3cc4ccccc4o3)c21

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIRT2 Q8IXJ6 2/20 0.39
SIRT1 Q96EB6 2/20 0.39
NPC1 O15118 3/20 0.39
RAB9A P51151 3/20 0.39
KDM4E B2RXH2 1/20 0.39
METAP2 P50579 1/20 0.39
ROCK1 Q13464 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
CDK4 P11802 2/20 0.37
CCND1 P24385 2/20 0.37
CCNE2 O96020 1/20 0.37
PRKACA P17612 1/20 0.37
PRKACG P22612 1/20 0.37
PRKACB P22694 1/20 0.37
CCNE1 P24864 1/20 0.37
CDK2 P24941 1/20 0.37
KDR P35968 2/20 0.37
AURKA O14965 1/20 0.37
AURKB Q96GD4 1/20 0.37
CYP1A1 P04798 1/20 0.36

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
SCHEMBL2886115 0.78 ROCK1 (0.45) KDM4EROCK1SMN1; SMN2CDK4CCND1
SCHEMBL2886445 0.76 SIRT2 (0.39) SIRT2SIRT1KDM4EROCK1SMN1; SMN2
SCHEMBL2883997 0.74 CNR1 (0.40) SIRT2SIRT1NPC1RAB9AKDM4E
SCHEMBL3032944 0.69 MAPT (0.40) SIRT2SIRT1NPC1RAB9AKDM4E
SCHEMBL2884558 0.68 GSK3A (0.59) RAB9AKDM4ETP53MAPTMEN1
SCHEMBL2883358 0.67 MEN1 (0.46) SIRT2SIRT1KDRMEN1KMT2A
SCHEMBL2887775 0.66 CDK5 (0.43) SIRT2SIRT1NPC1RAB9AKDM4E
SCHEMBL21023298 0.66 MAOA (0.43) SIRT2SIRT1NPC1RAB9AKDM4E
SCHEMBL31305724 0.66 RET (0.45) KDM4ESMN1; SMN2CDK4CCND1PRKACA
SCHEMBL25842866 0.66 NPC1 (0.46) SIRT2SIRT1NPC1RAB9AKDM4E

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 SIRT2 856/4885SIRT1 607/4885NPC1 4418/4885

“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.