SCHEMBL7305725

SCHEMBL7305725

CN(C(=O)CCCCCOc1c(F)ccc2c1N=C1NC(=O)C(CO)N1C2)C1CCCCC1

nearest known ligand 0.65

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 20/20 0.65
PDE3A Q14432 20/20 0.65
PDE4A P27815 1/20 0.46
PDE4B Q07343 1/20 0.46
PDE4C Q08493 1/20 0.46
PDE4D Q08499 1/20 0.46
P2RY12 Q9H244 1/20 0.46

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
SCHEMBL7315749 0.86 PDE3B (0.67) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7307664 0.84 PDE3B (0.71) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7321033 0.83 PDE3B (0.71) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7311903 0.82 PDE3B (0.94) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7319668 0.82 PDE3B (0.94) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7311995 0.81 PDE3B (0.71) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7311705 0.79 PDE3B (0.70) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7305564 0.79 PDE3B (1.00) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7312743 0.79 PDE3B (0.63) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7313288 0.77 PDE3B (0.49) PDE3BPDE3A

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