SCHEMBL7315870

SCHEMBL7315870

CCCOc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1-c1c(C#N)c(Cc2ccccc2)nn1CCC

nearest known ligand 0.51

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 20/20 0.51
PDE6C P51160 1/20 0.48
PDE11A Q9HCR9 1/20 0.48

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
SCHEMBL6194610 0.80 KMT2A (0.53) PDE5A
SCHEMBL7310252 0.73 PDE5A (0.50) PDE5APDE6CPDE11A
SCHEMBL6197392 0.73 PDE5A (0.83) PDE5APDE6CPDE11A
SCHEMBL16188276 0.72 TSHR (0.56) PDE5APDE6CPDE11A
SCHEMBL6774601 0.72 PDE5A (0.70) PDE5APDE6CPDE11A
SCHEMBL6199648 0.69 PDE5A (0.75) PDE5APDE6CPDE11A
SCHEMBL7312580 0.69 LMNA (0.42) PDE5A
SCHEMBL7307870 0.68 PDE5A (0.59) PDE5APDE6CPDE11A
SCHEMBL5827896 0.67 PDE5A (0.63) PDE5APDE6CPDE11A
SCHEMBL2566273 0.67 PDE5A (1.00) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6407114-B1 BENIGN PROSTATIC HYPERPLASIA, CARDIOVASCULAR, GASTROINTESTINAL AND RESPIRATORY DISORDER TREATMENT; ANTIASTHMATIC, ANTIALLERGEN, AND ANTIDIABETIC AGENTS PFIZER INC. 2002-06-18 US disclosed
EP-0995751-A2 Pyrazolopyrimidinone cGMP PDE5 inhibitors for the treatment of sexual dysfunction PFIZER INC. (US) 2000-04-26 EP disclosed