SCHEMBL4706090

SCHEMBL4706090

CCn1nc(-c2ccc(SC)cc2)c(C(C)=O)c(Nc2ccc(C(=O)OC)cc2)c1=O

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 2/20 0.65
ALDH1A1 P00352 3/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
MAPT P10636 3/20 0.40
TSHR P16473 2/20 0.40
GAA P10253 1/20 0.40
ALOX15 P16050 1/20 0.40
HTT P42858 1/20 0.40
HPGD P15428 2/20 0.39
FPR1 P21462 1/20 0.38
FPR2 P25090 1/20 0.38
P2RX3 P56373 1/20 0.37
PDE4A P27815 1/20 0.36
PDE4C Q08493 1/20 0.36
PDE4D Q08499 1/20 0.36
DHODH Q02127 1/20 0.36
MAPK1 P28482 1/20 0.36
KDM4E B2RXH2 2/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35

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
SCHEMBL4705654 0.90 PDE4B (0.80) PDE4BSMN1; SMN2HPGDFPR1FPR2
SCHEMBL4706947 0.88 PDE4B (0.83) PDE4BALDH1A1SMN1; SMN2MAPTTSHR
SCHEMBL3028604 0.87 PDE4B (0.68) PDE4BALDH1A1SMN1; SMN2MAPTHPGD
SCHEMBL4707779 0.87 PDE4B (0.77) PDE4BSMN1; SMN2PDE4APDE4CPDE4D
SCHEMBL4708373 0.85 PDE4B (0.63) PDE4BALDH1A1SMN1; SMN2MAPTHPGD
SCHEMBL3033360 0.82 PDE4B (0.61) PDE4BALDH1A1SMN1; SMN2MAPTGAA
SCHEMBL3033380 0.82 PDE4B (0.67) PDE4BALDH1A1SMN1; SMN2MAPTMAPK1
SCHEMBL4706143 0.81 PDE4B (0.80) PDE4BALDH1A1SMN1; SMN2MAPTTSHR
SCHEMBL4705837 0.80 PDE4B (0.56) PDE4BALDH1A1SMN1; SMN2MAPTHTT
SCHEMBL4708322 0.80 PDE4B (0.90) PDE4BSMN1; SMN2MAPTGAAKDR

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
US-7459453-B2 Pyridazin-3(2H)-one derivatives as PDE4 inhibitors LABORATORIOS ALMIRALL, S.A. (ES) 2008-12-02 US claimed
US-20060052379-A1 Pyridazin-3(2h)-one derivatives as pde4 inhibitors LABORATORIOS ALMIRALL, S.A. (ES) 2006-03-09 US claimed
EP-1503992-A1 PYRIDAZIN-3(2H)-ONE DERIVATIVES AS PDE4 INHIBITORS Almirall Prodesfarma, S.A. (ES) 2005-02-09 EP claimed
WO-2003097613-A1 PYRIDAZIN-3(2H)-ONE DERIVATIVES AS PDE4 INHIBITORS ALMIRALL PRODESFARMA SA (ES) 2003-11-27 WO claimed
US-7459453-B2 Pyridazin-3(2H)-one derivatives as PDE4 inhibitors LABORATORIOS ALMIRALL, S.A. (ES) 2008-12-02 US disclosed
US-20080269235-A1 PYRIDAZIN-3 (2H) -ONE DERIVATIVES AS PDE4 INHIBITORS DAL PIAZ VITTORIO 2008-10-30 US disclosed
US-20060052379-A1 Pyridazin-3(2h)-one derivatives as pde4 inhibitors LABORATORIOS ALMIRALL, S.A. (ES) 2006-03-09 US disclosed
EP-1503992-A1 PYRIDAZIN-3(2H)-ONE DERIVATIVES AS PDE4 INHIBITORS Almirall Prodesfarma, S.A. (ES) 2005-02-09 EP disclosed
WO-2003097613-A1 PYRIDAZIN-3(2H)-ONE DERIVATIVES AS PDE4 INHIBITORS ALMIRALL PRODESFARMA SA (ES) 2003-11-27 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 (2 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-20080269235-A1 PYRIDAZIN-3 (2H) -ONE DERIVATIVES AS PDE4 INHIBITORS PDE4A, PDE3A, PDE4B PDE4B 3/4885ALDH1A1 525/4885SMN1; SMN2 2927/4885
US-20060052379-A1 Pyridazin-3(2h)-one derivatives as pde4 inhibitors PDE4A, PDE3A, PDE4B PDE4B 3/4885ALDH1A1 525/4885SMN1; SMN2 2927/4885

“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.