SCHEMBL1995068

SCHEMBL1995068

CCn1nc(C(=O)OCc2ccccc2)c(C(C)=O)c(N)c1=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.48
KDM4E B2RXH2 4/20 0.48
MAOB P27338 3/20 0.48
ADORA2A P29274 3/20 0.48
PDE4A P27815 2/20 0.44
PDE4B Q07343 2/20 0.44
PDE4C Q08493 2/20 0.44
PDE4D Q08499 2/20 0.44
ALDH1A1 P00352 3/20 0.44
NPY1R P25929 1/20 0.44
RECQL P46063 1/20 0.44
NPY2R P49146 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
MAPK1 P28482 3/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
KMT2A Q03164 3/20 0.42
MEN1 O00255 2/20 0.42

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
SCHEMBL1996618 0.89 MAPK1 (0.43) MAPTKDM4EADORA2APDE4APDE4B
SCHEMBL2000048 0.87 ALDH1A1 (0.48) MAPTKDM4EMAOBADORA2APDE4A
SCHEMBL1998954 0.87 ALDH1A1 (0.54) MAPTKDM4EMAOBADORA2AALDH1A1
SCHEMBL1996657 0.83 ALDH1A1 (0.46) KDM4EPDE4APDE4BPDE4CPDE4D
SCHEMBL1994341 0.80 MAPT (0.46) MAPTKDM4EPDE4APDE4BPDE4C
SCHEMBL1997382 0.79 PDE4B (0.38) MAPTKDM4EPDE4APDE4BPDE4C
SCHEMBL1997065 0.79 TP53 (0.37) MAPTKDM4EPDE4APDE4BPDE4C
SCHEMBL1993161 0.78 PDE4A (0.35) MAPTPDE4APDE4BPDE4CPDE4D
SCHEMBL1998326 0.77 CSF1R (0.40) MAPTKDM4EPDE4APDE4BPDE4C
SCHEMBL1997288 0.77 PDE4B (0.46) MAPTKDM4EMAOBADORA2APDE4A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7960383-B2 phosphodiesterase enzyme inhibitor; 4-[(3-chlorophenyl)amino]-2-ethyl-5-(1-hydroxyethyl)-6-phenylpyridazin-3(2H)-one; potent antiinflammatory agent; asthma, atopic dermatitis, psoriasis, chronic obstructive pulmonary disease, rheumatoid arthritis, irritable bowel disease LABORATORIOS ALMIRALL SA (ES) 2011-06-14 US disclosed
EP-1758869-B1 PYRIDAZIN-3(2H)-ONE DERIVATIVES AND THEIR USE AS PDE4 INHIBITORS ALMIRALL SA (ES) 2010-12-22 EP disclosed
US-20080280918-A1 Pyridazin-3(2H)-One Derivatives and Their Use as Pde4 Inhibitors ALMIRALL PRODESFARMA, SA (ES) 2008-11-13 US disclosed
EP-1758869-A1 PYRIDAZIN-3(2H)-ONE DERIVATIVES AND THEIR USE AS PDE4 INHIBITORS Almirall Prodesfarma, S.A. (ES) 2007-03-07 EP disclosed
WO-2005123692-A1 PYRIDAZIN-3(2H)-ONE DERIVATIVES AND THEIR USE AS PDE4 INHIBITORS LABORATORIOS ALMIRALL, S.A. (ES) 2005-12-29 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-20080280918-A1 Pyridazin-3(2H)-One Derivatives and Their Use as Pde4 Inhibitors PDE12, PDE4A, PDE4B MAPT 2663/4885KDM4E 742/4885MAOB 233/4885

“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.