SCHEMBL2963896

SCHEMBL2963896

CCC(=O)c1cccn2nc(CC)cc12

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSP90AB1 P08238 1/20 0.35
MIF P14174 2/20 0.35
KMT2A Q03164 4/20 0.34
L3MBTL1 Q9Y468 1/20 0.33
PDE4B Q07343 5/20 0.33
PARP1 P09874 1/20 0.33
MEN1 O00255 3/20 0.32
NPSR1 Q6W5P4 2/20 0.32
MAPT P10636 1/20 0.32
TP53 P04637 1/20 0.32
NAMPT P43490 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
KLF5 Q13887 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
SPR P35270 1/20 0.32
PDE3A Q14432 3/20 0.32
TSHR P16473 2/20 0.32
USP2 O75604 1/20 0.32
HSD17B10 Q99714 1/20 0.32

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
SCHEMBL2963981 0.89 KDM4E (0.36) HSP90AB1MIFKMT2AL3MBTL1MEN1
SCHEMBL3222485 0.87 DHODH (0.40) PARP1SPRHSD17B10ALDH1A1EGFR
SCHEMBL2961374 0.86 KMT2A (0.38) MIFKMT2AL3MBTL1MEN1RAB9A
SCHEMBL13266060 0.86 PARP1 (0.33) MIFKMT2APDE4BPARP1MEN1
SCHEMBL2961579 0.85 PDE4B (0.36) MIFKMT2APDE4BMEN1NPSR1
SCHEMBL13266037 0.79 MIF (0.35) MIFKMT2APDE4BMEN1NPSR1
SCHEMBL2967764 0.78 MIF (0.35) MIFKMT2AL3MBTL1PDE4BMEN1
SCHEMBL2965155 0.77 PDE4B (0.35) MIFKMT2APDE4BMEN1NPSR1
SCHEMBL2960189 0.76 TGFBR1 (0.33) MIFPDE4BMAPTTP53NAMPT
SCHEMBL13266123 0.76 PDE4B (0.31) MIFKMT2APDE4BMEN1NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7763617-B2 Pyrazolopyridine-4-yl pyridazinone derivatives and addition salts thereof, and PDE inhibitors comprising the same derivatives or salts as active ingredient KYORIN PHARMACEUTICAL CO., LTD. (JP) 2010-07-27 US disclosed
US-7763617-B2 Pyrazolopyridine-4-yl pyridazinone derivatives and addition salts thereof, and PDE inhibitors comprising the same derivatives or salts as active ingredient KYORIN PHARMACEUTICAL CO., LTD. (JP) 2010-07-27 US disclosed
US-7763617-B2 Pyrazolopyridine-4-yl pyridazinone derivatives and addition salts thereof, and PDE inhibitors comprising the same derivatives or salts as active ingredient KYORIN PHARMACEUTICAL CO., LTD. (JP) 2010-07-27 US disclosed
US-20080207902-A1 Pyrazolopyridine-4-Yl Pyridazinone Derivatives and Addition Salts Thereof, and Pde Inhibitors Comprising the Same Derivatives or Salts as Active Ingredient KYORIN PHARMACEUTICAL CO., LTD. (JP) 2008-08-28 US disclosed
US-20080207902-A1 Pyrazolopyridine-4-Yl Pyridazinone Derivatives and Addition Salts Thereof, and Pde Inhibitors Comprising the Same Derivatives or Salts as Active Ingredient KYORIN PHARMACEUTICAL CO., LTD. (JP) 2008-08-28 US disclosed
US-20080207902-A1 Pyrazolopyridine-4-Yl Pyridazinone Derivatives and Addition Salts Thereof, and Pde Inhibitors Comprising the Same Derivatives or Salts as Active Ingredient KYORIN PHARMACEUTICAL CO., LTD. (JP) 2008-08-28 US 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-20080207902-A1 Pyrazolopyridine-4-Yl Pyridazinone Derivatives and Addition Salts Thereof, and Pde Inhibitors Comprising the Same Derivatives or Salts as Active Ingredient PDE5A, PDE3A, PDE3B HSP90AB1 3718/4885MIF 1939/4885KMT2A 2302/4885

“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.