SCHEMBL7360381

SCHEMBL7360381

CNC(CN)c1ccc(OC)c(OC2CCC3CCC2C3)c1

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 15/20 0.46
PDE4B Q07343 14/20 0.46
PDE4D Q08499 14/20 0.46
PDE4C Q08493 13/20 0.46
PDE3B Q13370 1/20 0.36
PDE3A Q14432 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
SCHEMBL7364049 0.93 PDE4B (0.52) PDE4APDE4BPDE4DPDE4CPDE3B
SCHEMBL7356450 0.83 LMNA (0.37) PDE4APDE4BPDE4DPDE4C
SCHEMBL7365858 0.83 PDE4B (0.51) PDE4APDE4BPDE4DPDE4CPDE3B
SCHEMBL9378730 0.81 PDE4A (0.40) PDE4APDE4BPDE4DPDE4C
SCHEMBL9376363 0.80 SCN9A (0.36) PDE4APDE4BPDE4DPDE4C
SCHEMBL4637176 0.78 PDE4B (0.59) PDE4APDE4BPDE4DPDE4C
SCHEMBL7361930 0.77 PDE4A (0.50) PDE4APDE4BPDE4DPDE4CPDE3B
SCHEMBL4637250 0.76 PDE4B (0.51) PDE4APDE4BPDE4DPDE4C
SCHEMBL7276559 0.74 PDE4B (0.58) PDE4APDE4BPDE4DPDE4CPDE3B
SCHEMBL7276546 0.74 PDE4B (0.58) PDE4APDE4BPDE4DPDE4CPDE3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5459145-A Calcium independent camp phosphodiesterase inhibitor antidepressant PFIZER INC. (US) 1995-10-17 US disclosed
US-5294730-A A-Amino-4-alkoxy-3-polycycloalkyloxybenzyl cyanide derivatives PFIZER INC. (US) 1994-03-15 US disclosed
EP-0247725-B1 Calcium independent camp phosphodiestrerase inhibitor antidepressant PFIZER (US) 1994-03-02 EP disclosed
US-5196426-A CALCIUM INDEPENDENT C AMP PHOSPHODIESTERASE INHIBITOR ANTIDEPRESSANT PFIZER INC. (US) 1993-03-23 US disclosed
US-5128358-A Aryl substituted nitrogen heterocyclic antidepressants PFIZER INC. (US) 1992-07-07 US disclosed
EP-0247725-A2 Calcium independent camp phosphodiestrerase inhibitor antidepressant PFIZER INC. (US) 1987-12-02 EP disclosed
WO-1987006576-A1 CALCIUM INDEPENDENT CAMP PHOSPHODIESTERASE INHIBITOR ANTIDEPRESSANT PFIZER INC. (US) 1987-11-05 WO disclosed