SCHEMBL7423136

SCHEMBL7423136

CCCn1c(=O)n(C)c(=O)c2[nH]c(-c3cc(S(=O)(=O)N4CCN(C)CC4)ccc3OCC)nc21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 20/20 1.00
PDE3B Q13370 2/20 0.83
PDE3A Q14432 2/20 0.83
PDE1A P54750 1/20 0.64
PDE1B Q01064 1/20 0.64
PDE1C Q14123 1/20 0.64

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
SCHEMBL5827710 0.87 PDE5A (0.77) PDE5APDE3BPDE3APDE1APDE1B
SCHEMBL6305175 0.84 PDE5A (0.72) PDE5APDE3BPDE3APDE1APDE1B
SCHEMBL6312725 0.83 PDE5A (0.71) PDE5APDE3BPDE3A
SCHEMBL5827623 0.83 PDE5A (0.73) PDE5APDE3BPDE3APDE1APDE1B
SCHEMBL5827328 0.82 PDE5A (0.89) PDE5A
SCHEMBL5827646 0.82 PDE5A (0.69) PDE5APDE3BPDE3A
SCHEMBL5827510 0.82 PDE5A (0.69) PDE5APDE3BPDE3A
SCHEMBL5827741 0.82 PDE5A (0.88) PDE5APDE3BPDE3A
SCHEMBL6308305 0.82 PDE5A (0.69) PDE5APDE3BPDE3APDE1APDE1B
SCHEMBL6313061 0.82 PDE5A (0.69) PDE5APDE3BPDE3APDE1APDE1B

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
WO-1999062905-A1 8-PHENYLXANTHINE DERIVATIVES AND THEIR USE AS PHOSPHODIESTERASE INHIBITORS ALMIRALL PRODESFARMA, S.A. (ES) 1999-12-09 WO disclosed