SCHEMBL8342256

SCHEMBL8342256

CC(=O)c1ccc2c(c1)[C@@H](NC(=O)c1c(F)cccc1Cl)[C@H](O)C(C)(C)O2

nearest known ligand 0.86

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ABCC9 O60706 5/20 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
SCHEMBL8342248 1.00 ABCC9 (0.52) ABCC9
SCHEMBL8342251 1.00 ABCC9 (0.52) ABCC9
SCHEMBL8338604 0.93 ABCC9 (0.56) ABCC9
SCHEMBL8338595 0.93 ABCC9 (0.56) ABCC9
SCHEMBL8338599 0.93 ABCC9 (0.56) ABCC9
SCHEMBL8342281 0.86 ABCC9 (0.52) ABCC9
SCHEMBL8342275 0.86 ABCC9 (0.52) ABCC9
SCHEMBL8342272 0.86 ABCC9 (0.52) ABCC9
Tonabersat SCHEMBL7169677 0.85 ABCC9 (0.62) ABCC9
Tonabersat SCHEMBL5917016 0.85 ABCC9 (0.62) ABCC9

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5908860-A Bicyclic compounds with pharmaceutical activity SMITHKLINE BEECHAM PLC, (GB) 1999-06-01 US claimed
WO-1994013656-A1 BICYCLIC COMPOUNDS WITH PHARMACEUTICAL ACTIVITY SMITHKLINE BEECHAM PLC (GB) 1994-06-23 WO claimed
US-5908860-A Bicyclic compounds with pharmaceutical activity SMITHKLINE BEECHAM PLC, (GB) 1999-06-01 US disclosed
WO-1994013656-A1 BICYCLIC COMPOUNDS WITH PHARMACEUTICAL ACTIVITY SMITHKLINE BEECHAM PLC (GB) 1994-06-23 WO disclosed