SCHEMBL7479115

SCHEMBL7479115

CCc1ccc2c(c1)C(NCCC(=O)c1ccc(F)cc1)C(O)C(C)(C)O2

nearest known ligand 0.53

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 9/20 0.45
ABCC9 O60706 1/20 0.41
ABCB1 P08183 4/20 0.40
KCNE1 P15382 3/20 0.40
KCNQ1 P51787 3/20 0.40

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
SCHEMBL7479126 1.00 KCNA5 (0.45) KCNA5ABCC9ABCB1KCNE1KCNQ1
SCHEMBL7479109 1.00 KCNA5 (0.45) KCNA5ABCC9ABCB1KCNE1KCNQ1
SCHEMBL7477716 0.90 KCNA5 (0.49) KCNA5ABCC9ABCB1
SCHEMBL7480334 0.90 KCNA5 (0.49) KCNA5ABCC9ABCB1
SCHEMBL7477727 0.90 KCNA5 (0.49) KCNA5ABCC9ABCB1
SCHEMBL7472242 0.84 ABCC9 (0.61) ABCC9ABCB1
SCHEMBL7472234 0.84 ABCC9 (0.61) ABCC9ABCB1
SCHEMBL7472250 0.84 ABCC9 (0.61) ABCC9ABCB1
SCHEMBL3303787 0.83 ABCC9 (0.59) KCNA5ABCC9
SCHEMBL7475538 0.83 ABCC9 (0.59) KCNA5ABCC9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0587645-B1 BENZO- AND PYRIDOPYRAN DERIVATIVES HAVING ANXIOLYTIC AND ANTI-CONVULSANT ACTIVITY SMITHKLINE BEECHAM PLC (GB) 2002-02-27 EP claimed
WO-1994012173-A1 BENZOPYRON ANALOGUES FOR THE TREATMENT OF ANXIETY, MANIA, DEPRESSION OR WITHDRAWAL SYMPTOMS SMITHKLINE BEECHAM PLC (GB) 1994-06-09 WO claimed
EP-0587645-B1 BENZO- AND PYRIDOPYRAN DERIVATIVES HAVING ANXIOLYTIC AND ANTI-CONVULSANT ACTIVITY SMITHKLINE BEECHAM PLC (GB) 2002-02-27 EP disclosed
EP-1108718-A2 Trans-6-Acetyl-4S-(4-fluorobenzoylamino)-3,4-dihydro-2,2-dimethyl-2H-1-benzopyran-3R-ol SMITHKLINE BEECHAM PLC (GB) 2001-06-20 EP disclosed
US-5889044-A Benzo- and pyridopyran derivatives having anxiolytic and anti-convulsant activity SMITHKLINE BEECHAM P.L.C. (GB) 1999-03-30 US disclosed
US-5624954-A Benzo- and pyridopyran derivatives having anxiolytic and anti-convulsant activity SMITHKLINE BEECHAM P.L.C. (GB) 1997-04-29 US disclosed
WO-1994012173-A1 BENZOPYRON ANALOGUES FOR THE TREATMENT OF ANXIETY, MANIA, DEPRESSION OR WITHDRAWAL SYMPTOMS SMITHKLINE BEECHAM PLC (GB) 1994-06-09 WO disclosed