SCHEMBL6584281

SCHEMBL6584281

COc1ccc2c(=O)[nH]ncc2c1OC1CCOC1

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 14/20 0.52
PDE4B Q07343 11/20 0.52
PDE4A P27815 9/20 0.52
PDE4C Q08493 9/20 0.52
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
HPGD P15428 1/20 0.41
MAPK1 P28482 1/20 0.41
HSD17B10 Q99714 1/20 0.41
LMNA P02545 1/20 0.37
CHEK1 O14757 1/20 0.36
GAA P10253 1/20 0.36

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
SCHEMBL6585673 0.84 PDE4B (0.48) PDE4DPDE4BPDE4APDE4CKDM4E
SCHEMBL7508465 0.82 PDE4B (0.42) PDE4DPDE4BPDE4APDE4CKDM4E
SCHEMBL6585114 0.80 PDE4B (0.52) PDE4DPDE4BPDE4APDE4CKDM4E
SCHEMBL6584184 0.79 PDE4B (0.50) PDE4DPDE4BPDE4APDE4CKDM4E
SCHEMBL29058957 0.77 PDE4D (0.45) PDE4DPDE4BPDE4APDE4CCHEK1
SCHEMBL30544671 0.77 PDE4D (0.45) PDE4DPDE4BPDE4APDE4CCHEK1
SCHEMBL29058960 0.77 PDE4D (0.45) PDE4DPDE4BPDE4APDE4CCHEK1
SCHEMBL6588075 0.76 PDE4D (0.68) PDE4DPDE4BPDE4APDE4C
SCHEMBL29702425 0.73 ROCK1 (0.43) PDE4BALDH1A1HSD17B10
SCHEMBL7562777 0.72 PDE4B (0.44) PDE4DPDE4BPDE4APDE4CKDM4E

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-20040043999-A1 Phthalazine derivatives as phosphodiesterase 4-inhibitors ZAMBON GROUP S.P.A 2004-03-04 US disclosed
EP-1042300-B1 PHTHALAZINE DERIVATIVES USEFUL AS PHOSPHODIESTERASE 4 INHIBITORS ZAMBON SPA (IT) 2004-02-11 EP disclosed
US-6589951-B1 N right-arrowO derivatives and pharmaceutically acceptable salt thereof are PDE 4 and TNF pharmaceutically acceptable salt thereof are PDE 4 and TNF alpha inhibitors. ZAMBON GROUP S.P.A. (IT) 2003-07-08 US disclosed
EP-1042300-A1 PHTHALAZINE DERIVATIVES PHOSPHODIESTERASE 4 INHIBITORS ZAMBON GROUP S.p.A. (IT) 2000-10-11 EP disclosed
WO-1999032456-A1 PHTHALAZINE DERIVATIVES PHOSPHODIESTERASE 4 INHIBITORS ZAMBON GROUP S.P.A. (IT) 1999-07-01 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-20040043999-A1 Phthalazine derivatives as phosphodiesterase 4-inhibitors PDE5A, PDE3B, PDE3A PDE4D 22/4885PDE4B 9/4885PDE4A 7/4885

“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.