SCHEMBL8206998

SCHEMBL8206998

CCCOc1ccc(S(=O)(=O)N2CCN(CC)CC2)cc1-c1nc2cc3ncn(Cc4cccc(F)c4)c3cc2c(=O)[nH]1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ PDE5A O76074 20/20 1.00

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
SCHEMBL8206739 0.93 PDE5A (1.00) PDE5A
SCHEMBL7411835 0.93 PDE5A (1.00) PDE5A
SCHEMBL8199757 0.92 PDE5A (1.00) PDE5A
SCHEMBL7403852 0.88 PDE5A (0.91) PDE5A
SCHEMBL8206798 0.87 PDE5A (1.00) PDE5A
SCHEMBL8211750 0.87 PDE5A (1.00) PDE5A
SCHEMBL7412557 0.87 PDE5A (1.00) PDE5A
SCHEMBL8199381 0.86 PDE5A (1.00) PDE5A
SCHEMBL8212460 0.86 PDE5A (0.89) PDE5A
SCHEMBL7408039 0.86 PDE5A (0.87) PDE5A

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