SCHEMBL11068044

SCHEMBL11068044

O=C1CCc2cc(OCCCC(=O)N(CCOC(=O)c3ccccc3)C3CCCCC3)ccc2N1

nearest known ligand 0.66

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 18/20 0.66
PDE3A Q14432 18/20 0.66
MAOA P21397 2/20 0.49
MAOB P27338 2/20 0.49

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
SCHEMBL11062815 0.98 PDE3B (0.62) PDE3BPDE3AMAOAMAOB
SCHEMBL11065398 0.94 PDE3B (0.63) PDE3BPDE3AMAOAMAOB
SCHEMBL11062100 0.93 PDE3B (0.56) PDE3BPDE3AMAOAMAOB
SCHEMBL11062085 0.92 PDE3B (0.57) PDE3BPDE3AMAOAMAOB
SCHEMBL11064459 0.88 PDE3B (0.73) PDE3BPDE3A
SCHEMBL11065080 0.87 PDE3B (0.71) PDE3BPDE3A
SCHEMBL11064248 0.87 PDE3B (0.59) PDE3BPDE3AMAOAMAOB
SCHEMBL11067828 0.86 PDE3B (0.75) PDE3BPDE3A
SCHEMBL11061870 0.86 PDE3B (0.75) PDE3BPDE3A
SCHEMBL11067894 0.86 PDE3B (0.75) 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-4435404-A ANTICOAGULANTS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1984-03-06 US disclosed