SCHEMBL4705814

SCHEMBL4705814

CC(=O)c1c(-c2ccccc2)nn(C(C)C)c(=O)c1Nc1cccc(Cl)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE4B Q07343 1/20 0.48
▸ PARP1 P09874 2/20 0.45
▸ MAPT P10636 3/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ PPARG P37231 1/20 0.43
▸ NR2E3 Q9Y5X4 1/20 0.43
▸ NCOR2 Q9Y618 1/20 0.43
▸ ACHE P22303 1/20 0.43
▸ BACE1 P56817 1/20 0.43
▸ LMNA P02545 1/20 0.43
▸ GPR35 Q9HC97 1/20 0.43
▸ ADORA3 P0DMS8 1/20 0.42
▸ ADORA2A P29274 1/20 0.42
▸ ADORA1 P30542 1/20 0.42
▸ HTR1A P08908 3/20 0.42
▸ ADRA1D P25100 3/20 0.42
▸ ADRA1A P35348 3/20 0.42
▸ ADRA1B P35368 3/20 0.42
▸ RIPK1 Q13546 1/20 0.41
▸ CSF1R P07333 1/20 0.41

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
SCHEMBL4708408 0.92 PDE4B (0.50) PDE4BPARP1MAPTSMN1; SMN2LMNA
SCHEMBL4708887 0.90 PDE4B (0.39) PDE4BPARP1MAPTSMN1; SMN2PPARG
SCHEMBL4707163 0.88 PDE4B (0.48) PDE4BMAPTSMN1; SMN2LMNAHTR1A
SCHEMBL4707251 0.86 MAPT (0.55) PDE4BPARP1MAPTSMN1; SMN2PPARG
SCHEMBL4708005 0.86 ALDH1A1 (0.48) PDE4BACHEBACE1ADORA1CSF1R
SCHEMBL4706455 0.84 RIPK1 (0.51) PDE4BPARP1MAPTSMN1; SMN2PPARG
SCHEMBL4058811 0.84 PDE4B (0.70) PDE4BPARP1MAPTSMN1; SMN2PPARG
SCHEMBL4707413 0.83 PDE4B (0.50) PDE4BMAPTSMN1; SMN2LMNAGPR35
SCHEMBL4707150 0.83 PDE4B (0.57) PDE4BPARP1MAPTSMN1; SMN2PPARG
SCHEMBL4707571 0.82 PDE4B (0.46) PDE4BMAPTSMN1; SMN2ACHEBACE1

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-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 3/4885PARP1 1082/4885MAPT 3692/4885
US-20060052379-A1 Pyridazin-3(2h)-one derivatives as pde4 inhibitors PDE4A, PDE3A, PDE4B PDE4B 3/4885PARP1 1082/4885MAPT 3692/4885

“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.

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