SCHEMBL3426580

SCHEMBL3426580

CN1CCN(Cc2ccc3c(Cc4ccccc4)c(-c4cc(-c5ccncc5)n[nH]c4=O)[nH]c3c2)CC1

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 1/20 0.47
PARP1 P09874 6/20 0.44
PARP2 Q9UGN5 3/20 0.43
KCNH2 Q12809 2/20 0.43
KDR P35968 3/20 0.42
FGFR1 P11362 2/20 0.42
PDGFRB P09619 1/20 0.42
PIM1 P11309 1/20 0.42
CSNK1D P48730 1/20 0.42
FLT1 P17948 1/20 0.41
KIF11 P52732 1/20 0.41
ROCK1 Q13464 2/20 0.41
POLB P06746 1/20 0.41
ITK Q08881 2/20 0.40
ROCK2 O75116 1/20 0.39
NAMPT P43490 1/20 0.39

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
SCHEMBL3425881 0.91 GSK3B (0.49) GSK3BPARP1PARP2KCNH2KDR
SCHEMBL3427264 0.89 GSK3B (0.48) GSK3BPARP1PARP2KCNH2KDR
SCHEMBL3421444 0.88 GSK3B (0.47) GSK3BPARP1PARP2KCNH2KDR
SCHEMBL3427546 0.83 TLR8 (0.40) PARP1PARP2KCNH2KDRFGFR1
SCHEMBL3425574 0.82 GSK3B (0.46) GSK3BPARP1ITK
SCHEMBL3425442 0.81 PARP1 (0.43) GSK3BPARP1PARP2KCNH2
SCHEMBL1750686 0.78 HTR2A (0.41) ROCK1POLB
SCHEMBL1751277 0.78 PARP1 (0.45) GSK3BPARP1PARP2KCNH2
SCHEMBL1750773 0.78 CHEK1 (0.47) GSK3BPARP1
SCHEMBL1750093 0.78 GSK3B (0.54) GSK3BPARP1PARP2KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7709466-B2 Pyridazinone derivatives, methods for their production and their use as pharmaceuticals SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2010-05-04 US claimed
EP-1753743-B1 PYRIDAZINONE DERIVATIVES, METHODS FOR PRODUCING THEM AND THEIR USE AS PHARMACEUTICALS SANOFI AVENTIS DEUTSCHLAND (DE) 2015-03-04 EP disclosed
US-7709466-B2 Pyridazinone derivatives, methods for their production and their use as pharmaceuticals SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2010-05-04 US disclosed
US-7709466-B2 Pyridazinone derivatives, methods for their production and their use as pharmaceuticals SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2010-05-04 US disclosed
US-7709466-B2 Pyridazinone derivatives, methods for their production and their use as pharmaceuticals SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2010-05-04 US disclosed
US-20070088041-A1 PYRIDAZINONE DERIVATIVES, METHODS FOR THEIR PRODUCTION AND THEIR USE AS PHARMACEUTICALS SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2007-04-19 US disclosed
US-20070088041-A1 PYRIDAZINONE DERIVATIVES, METHODS FOR THEIR PRODUCTION AND THEIR USE AS PHARMACEUTICALS SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2007-04-19 US disclosed
US-20070088041-A1 PYRIDAZINONE DERIVATIVES, METHODS FOR THEIR PRODUCTION AND THEIR USE AS PHARMACEUTICALS SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2007-04-19 US disclosed
EP-1753743-A1 PYRIDAZINONE DERIVATIVES, METHODS FOR PRODUCING THEM AND THEIR USE AS PHARMACEUTICALS Sanofi-Aventis Deutschland GmbH (DE) 2007-02-21 EP disclosed
WO-2005111018-A1 PYRIDAZINONE DERIVATIVES, METHODS FOR PRODUCING THEM AND THEIR USE AS PHARMACEUTICALS SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2005-11-24 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-20070088041-A1 PYRIDAZINONE DERIVATIVES, METHODS FOR THEIR PRODUCTION AND THEIR USE AS PHARMACEUTICALS GSK3B, GSK3A, PDXK GSK3B 1/4885PARP1 992/4885PARP2 1061/4885

“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.