SCHEMBL7246707

SCHEMBL7246707

CCCc1c2nc(-c3cc(S(=O)(=O)N(C)C)cnc3OCC)[nH]c(=O)c2nn1Cc1ccccn1

nearest known ligand 0.65

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 19/20 0.65
PDE6C P51160 2/20 0.65
ALDH1A1 P00352 1/20 0.42
MAPT P10636 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42

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
SCHEMBL6447206 0.91 PDE5A (0.67) PDE5APDE6C
SCHEMBL6441913 0.86 PDE5A (0.69) PDE5APDE6C
SCHEMBL6446885 0.86 PDE5A (0.70) PDE5APDE6CALDH1A1
SCHEMBL6447170 0.86 PDE5A (0.78) PDE5APDE6C
SCHEMBL7239340 0.85 PDE5A (0.68) PDE5APDE6CALDH1A1MAPTSMN1; SMN2
SCHEMBL7248338 0.85 PDE5A (0.61) PDE5APDE6C
Hydrochloric Acid SCHEMBL6443324 0.84 PDE5A (0.65) PDE5APDE6C
SCHEMBL6441959 0.83 PDE5A (0.69) PDE5APDE6C
SCHEMBL6443099 0.82 PDE5A (0.67) PDE5APDE6C
SCHEMBL7244120 0.81 PDE5A (0.57) 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-6670366-B1 Cyclic guanosine 3',5'-monophosphate phosphodiesterase inhibitors; impotence; pyrazolo(4,3-d)pyrimidin-7-ones PFIZER INC 2003-12-30 US disclosed
EP-0995750-A1 Pyrazolopyrimidinone cGMP PDE5 inhibitors for the treatment of sexual dysfunction PFIZER INC. (US) 2000-04-26 EP disclosed