SCHEMBL10667189

SCHEMBL10667189

CC(C)(C)NC(=O)CN1Cc2c(cccc2OCCCCC(=O)N(CCCCCCO)C2CCCC2)N=C1N

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 4/20 0.42
PDE3A Q14432 4/20 0.42
PDE4A P27815 16/20 0.41
PDE4B Q07343 16/20 0.41
PDE4C Q08493 16/20 0.41
PDE4D Q08499 16/20 0.41

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
SCHEMBL10651619 0.92 PDE3B (0.47) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10672124 0.89 PDE4A (0.52) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10648231 0.85 PDE4A (0.44) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10649953 0.85 PDE4A (0.45) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10668129 0.82 PDE3B (0.48) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10648822 0.81 PDE4A (0.44) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10649193 0.81 PDE4A (0.57) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10652617 0.81 PDE4A (0.43) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10652204 0.81 PDE4A (0.47) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10669884 0.80 PDE4A (0.41) PDE3BPDE3APDE4APDE4BPDE4C

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-4761416-A ENZYME INHIBITORS, INOTROPIC AGENTS SYNTEX (U.S.A.) INC. (US) 1988-08-02 US disclosed