SCHEMBL7361927

SCHEMBL7361927

COc1ccc(CCNNCCc2ccccc2)cc1OC1CC2CCC1C2

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 10/20 0.51
PDE4A P27815 9/20 0.51
PDE4C Q08493 9/20 0.51
PDE4D Q08499 9/20 0.51
PDE3B Q13370 1/20 0.46
PDE3A Q14432 1/20 0.46
ALDH1A1 P00352 3/20 0.45
TSHR P16473 1/20 0.45
SIGMAR1 Q99720 2/20 0.44
PLAAT3 P53816 1/20 0.43
PLAAT5 Q96KN8 1/20 0.43
PLAAT2 Q9NWW9 1/20 0.43
PLAAT4 Q9UL19 1/20 0.43
RAB9A P51151 2/20 0.42
LMNA P02545 1/20 0.42
MAPT P10636 1/20 0.42
HTT P42858 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
SLC2A1 P11166 1/20 0.42
NPC1 O15118 1/20 0.42

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
SCHEMBL7361930 0.80 PDE4A (0.50) PDE4BPDE4APDE4CPDE4DPDE3B
SCHEMBL7358975 0.79 PDE4B (0.56) PDE4BPDE4APDE4CPDE4DPDE3B
SCHEMBL7362286 0.79 PDE4B (0.56) PDE4BPDE4APDE4CPDE4DPDE3B
SCHEMBL7362675 0.79 PDE4B (0.59) PDE4BPDE4APDE4CPDE4DPDE3B
SCHEMBL7362274 0.76 PDE4B (0.53) PDE4BPDE4APDE4CPDE4DPDE3B
SCHEMBL9580298 0.75 PDE4B (0.55) PDE4BPDE4APDE4CPDE4DPDE3B
SCHEMBL14619846 0.75 PDE4B (0.55) PDE4BPDE4APDE4CPDE4DPDE3B
SCHEMBL13111721 0.75 PDE4B (0.51) PDE4BPDE4APDE4CPDE4DPDE3B
SCHEMBL7371302 0.74 PDE4B (0.62) PDE4BPDE4APDE4CPDE4DPDE3B
SCHEMBL7368326 0.72 PDE4B (0.62) PDE4BPDE4APDE4CPDE4DPDE3B

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