SCHEMBL498001

SCHEMBL498001

COc1ccc(C2C=NNC(=O)C2)cc1OC1CCCC1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 18/20 0.60
PDE4A P27815 15/20 0.60
PDE4C Q08493 13/20 0.60
PDE4D Q08499 13/20 0.60
CYP3A4 P08684 2/20 0.60
VEGFA P15692 1/20 0.60
ALDH1A1 P00352 1/20 0.60
LMNA P02545 1/20 0.60
CYP1A2 P05177 1/20 0.60
MAPT P10636 1/20 0.60
CYP2C9 P11712 1/20 0.60
ALOX15 P16050 1/20 0.60
CREBBP Q92793 1/20 0.60
KDM4E B2RXH2 1/20 0.60
PDE5A O76074 1/20 0.60
TNF P01375 1/20 0.60
MAPK1 P28482 1/20 0.60
BLM P54132 1/20 0.60
PDE1A P54750 1/20 0.60
PDE1B Q01064 1/20 0.60

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
SCHEMBL498074 0.88 PDE4A (0.52) PDE4BPDE4APDE4CPDE4DCYP3A4
SCHEMBL6228022 0.86 PDE4A (0.47) PDE4BPDE4APDE4CPDE4DCYP3A4
SCHEMBL6228237 0.81 PDE4B (0.48) PDE4BPDE4APDE4CPDE4D
SCHEMBL6232341 0.78 PDE4A (0.60) PDE4BPDE4APDE4CPDE4DCYP3A4
SCHEMBL6229342 0.78 PDE4A (0.60) PDE4BPDE4APDE4CPDE4DALOX15
SCHEMBL6229565 0.78 PDE4A (0.44) PDE4BPDE4APDE4CPDE4DCYP3A4
SCHEMBL6227674 0.78 PDE4A (0.60) PDE4BPDE4APDE4CPDE4DCYP3A4
SCHEMBL3173894 0.77 PDE4B (0.77) PDE4BPDE4APDE4CPDE4DCYP3A4
SCHEMBL6232762 0.76 PDE4A (0.62) PDE4BPDE4APDE4CPDE4DMAPK1
SCHEMBL6233638 0.76 PDE4A (0.50) PDE4BPDE4APDE4CPDE4DVEGFA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2157084-B1 5-PHENYL-3-PYRIDAZINONE DERIVATIVE KOWA CO (JP) 2013-05-22 EP disclosed
US-8106053-B2 5-phenyl-3-pyridazinone derivative KOWA COMPANY, LTD. 2012-01-31 US disclosed
US-20100197698-A1 5-PHENYL-3-PYRIDAZINONE DERIVATIVE KOWA COMPANY, LTD. (JP) 2010-08-05 US disclosed
EP-2193808-A1 Synergistic combination Nycomed GmbH (DE) 2010-06-09 EP disclosed
EP-2157084-A1 5-PHENYL-3-PYRIDAZINONE DERIVATIVE Kowa Company, Ltd. (JP) 2010-02-24 EP disclosed
EP-1849468-A2 Pharmaceutical composition of a pde4 or a pde3/4 inhibitor and a histamine receptor antagonist Nycomed GmbH (DE) 2007-10-31 EP disclosed
EP-0933366-B1 5-PHENYL-3-PYRIDAZINONE DERIVATIVES AND DRUG COMPOSITIONS CONTAINING THE SAME NIKKEN CHEMICALS CO LTD (JP) 2005-04-06 EP disclosed
WO-2004047817-A1 PDE4 AND PDE3/4 INHIBITORS FOR USE IN THE TREATMENT OF CACHEXIA ALTANA PHARMA AG (DE) 2004-06-10 WO disclosed
WO-2003024488-A2 COMBINATION OF A PDE INHIBITOR AND A LEUKOTRIENE RECEPTOR ANTAGONIST ALTANA PHARMA AG (DE) 2003-03-27 WO disclosed
US-6235739-B1 ANTIINFLAMMATORY AGENTS; ANTIHISTAMINES; SKIN DISORDERS NIKKEN CHEMICALS CO., LTD. (JP) 2001-05-22 US disclosed
EP-0933366-A1 5-PHENYL-3-PYRIDAZINONE DERIVATIVES AND DRUG COMPOSITIONS CONTAINING THE SAME Nikken Chemicals Company, Limited (JP) 1999-08-04 EP 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-20100197698-A1 5-PHENYL-3-PYRIDAZINONE DERIVATIVE SERPINE1, MMP1, PLAT PDE4B 1932/4885PDE4A 2167/4885PDE4C 2802/4885

“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.