SCHEMBL7309032

SCHEMBL7309032

NC(=O)C(CCOc1ccc2c(c1)CN1C(=N2)NC(=O)C1CO)N1CCCC1

nearest known ligand 0.58

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 19/20 0.58
PDE3A Q14432 19/20 0.58
PDE4A P27815 1/20 0.42
PDE4B Q07343 1/20 0.42
PDE4C Q08493 1/20 0.42
PDE4D Q08499 1/20 0.42
P2RY12 Q9H244 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
SCHEMBL7312180 0.99 PDE3B (0.59) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7308814 0.85 PDE3B (0.52) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7319827 0.85 PDE3B (0.51) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7309048 0.83 PDE3B (0.54) PDE3BPDE3AP2RY12
SCHEMBL10374756 0.82 PDE3B (0.68) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7312202 0.82 PDE3B (0.55) PDE3BPDE3A
SCHEMBL10374967 0.82 PDE3B (0.67) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10845586 0.81 PDE3B (0.66) PDE3BPDE3AP2RY12
SCHEMBL10844200 0.81 PDE3B (0.67) PDE3BPDE3AP2RY12
SCHEMBL7309036 0.80 PDE3B (0.67) PDE3BPDE3AP2RY12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4670434-A ANTICOAGULANT, INOTROPIC AGENT SYNTEX (U.S.A.) INC. (US) 1987-06-02 US disclosed