SCHEMBL8207666

SCHEMBL8207666

CCCOc1ccc(S(=O)(=O)N2CCN(C(C)=O)CC2)cc1-c1nc2cc(Cl)c([N+](=O)[O-])cc2c(=O)[nH]1

nearest known ligand 0.59

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ PDE5A O76074 20/20 0.59
▸ PDE6C P51160 1/20 0.52
▸ PDE11A Q9HCR9 1/20 0.52

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
SCHEMBL8206349 0.92 PDE5A (0.58) PDE5APDE6CPDE11A
SCHEMBL7373885 0.91 PDE5A (0.71) PDE5APDE6CPDE11A
SCHEMBL7376362 0.90 PDE5A (0.66) PDE5APDE6CPDE11A
SCHEMBL7369832 0.87 PDE5A (0.65) PDE5APDE6CPDE11A
SCHEMBL7377725 0.87 PDE5A (0.68) PDE5APDE6CPDE11A
SCHEMBL8207695 0.87 VCAM1 (0.59) PDE5A
SCHEMBL7372006 0.84 PDE5A (0.51) PDE5A
SCHEMBL7407315 0.84 PDE5A (0.83) PDE5APDE6CPDE11A
SCHEMBL7378244 0.83 PDE5A (0.70) PDE5APDE6CPDE11A
SCHEMBL7371213 0.82 PDE5A (0.64) PDE5APDE6CPDE11A

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-6087368-A AN ENZYME INHIBITOR TREATING ERECTILE DYSFUNCTION OF SEX DISORDERS BRISTOL-MYERS SQUIBB COMPANY (US) 2000-07-11 — — US disclosed
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