Sugi Predict

Sugi Predict / Compounds / SCHEMBL6773115

SCHEMBL6773115

SCHEMBL6773115

CCCCOc1ncc(C(C)=O)cc1-c1nc2c(CC)n(C3CCN(C)CC3)nc2c(=O)[nH]1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ PDE5A O76074 20/20 1.00
▸ PDE6C P51160 1/20 0.79

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
SCHEMBL6777243 0.96 PDE5A (1.00) PDE5APDE6C
SCHEMBL6777618 0.93 PDE5A (0.87) PDE5APDE6C
SCHEMBL6777359 0.92 PDE5A (0.86) PDE5APDE6C
SCHEMBL6777553 0.92 PDE5A (1.00) PDE5APDE6C
SCHEMBL6772837 0.91 PDE5A (1.00) PDE5APDE6C
SCHEMBL6783033 0.90 PDE5A (0.85) PDE5APDE6C
SCHEMBL6359521 0.90 PDE5A (1.00) PDE5APDE6C
SCHEMBL6771870 0.89 PDE5A (1.00) PDE5APDE6C
SCHEMBL6783169 0.89 PDE5A (0.87) PDE5APDE6C
SCHEMBL2033129 0.88 PDE5A (0.79) PDE5APDE6C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6756373-B1 SUCH AS 5-(2-BUTOXY-5-IODO-3-PYRIDINYL)-3-ETHYL-2-(2-METHOXY-ETHYL)-2,6-DIHYDRO-7H -PYRAZOLO(4,3-D)PYRIMIDIN-7-ONE; CYCLIC GUANOSINE 3',5'-MONOPHOSPHATE PHOSPHODIESTERASE INHIBITORS; ERECTILE DYSFUNCTION PFIZER INC. 2004-06-29 — — US claimed
US-6756373-B1 SUCH AS 5-(2-BUTOXY-5-IODO-3-PYRIDINYL)-3-ETHYL-2-(2-METHOXY-ETHYL)-2,6-DIHYDRO-7H -PYRAZOLO(4,3-D)PYRIMIDIN-7-ONE; CYCLIC GUANOSINE 3',5'-MONOPHOSPHATE PHOSPHODIESTERASE INHIBITORS; ERECTILE DYSFUNCTION PFIZER INC. 2004-06-29 — — US disclosed