SCHEMBL9260769

SCHEMBL9260769

COc1ccc(-c2ccc(N)nn2)cc1OC1CCCC1

nearest known ligand 0.56

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 15/20 0.56
PDE4B Q07343 10/20 0.55
PDE4C Q08493 10/20 0.55
PDE4D Q08499 10/20 0.55
FPR2 P25090 2/20 0.50
S1PR1 P21453 1/20 0.48
S1PR3 Q99500 1/20 0.48
TPH1 P17752 1/20 0.48

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
SCHEMBL9257412 0.99 PDE4A (0.55) PDE4APDE4BPDE4CPDE4DFPR2
SCHEMBL9266611 0.99 PDE4A (0.55) PDE4APDE4BPDE4CPDE4DFPR2
SCHEMBL9269661 0.85 PDE4D (0.46) PDE4APDE4BPDE4CPDE4DFPR2
SCHEMBL9183609 0.85 PDE4A (0.56) PDE4APDE4BPDE4CPDE4DFPR2
SCHEMBL1752782 0.83 ALDH1A1 (0.50) PDE4APDE4BPDE4CPDE4D
SCHEMBL5823060 0.80 PDE4A (0.77) PDE4APDE4BPDE4CPDE4DFPR2
SCHEMBL7416259 0.80 PDE4A (0.58) PDE4APDE4BPDE4CPDE4DFPR2
SCHEMBL9265518 0.79 TRPC6 (0.50) PDE4APDE4BPDE4CPDE4DFPR2
SCHEMBL9185677 0.79 PDE4A (0.53) PDE4APDE4BPDE4CPDE4DS1PR1
SCHEMBL7450822 0.78 PDE4A (0.71) PDE4APDE4BPDE4CPDE4DFPR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5449676-A Bronchodilator agents BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 1995-09-12 US disclosed
EP-0581805-A1 NOVEL PYRIDAZINES BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 1994-02-09 EP disclosed
WO-1992019602-A1 NOVEL PYRIDAZINES BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 1992-11-12 WO disclosed
EP-0510562-A1 Pyridazines Byk Gulden Lomberg Chemische Fabrik GmbH (DE) 1992-10-28 EP disclosed