SCHEMBL7141377

SCHEMBL7141377

CC(=O)c1ccc2c(c1)[C@H](NC(=O)c1cc(Cl)cc(Cl)c1)[C@@H](O)C(C)(C)O2

nearest known ligand 0.82

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ABCC9 O60706 5/20 0.62

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
SCHEMBL8338376 0.92 ABCC9 (0.73) ABCC9
SCHEMBL8338373 0.92 ABCC9 (0.73) ABCC9
SCHEMBL8338368 0.92 ABCC9 (0.73) ABCC9
SCHEMBL8342004 0.90 ABCC9 (0.73) ABCC9
SCHEMBL8341994 0.90 ABCC9 (0.73) ABCC9
SCHEMBL8342000 0.90 ABCC9 (0.73) ABCC9
SCHEMBL3310335 0.90 ABCC9 (0.73) ABCC9
SCHEMBL16089477 0.87 ABCC9 (0.59) ABCC9
Tonabersat SCHEMBL7169677 0.87 ABCC9 (0.62) ABCC9
Tonabersat SCHEMBL29377931 0.87 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0764157-B1 BENZOPYRANS AND THEIR USE AS THERAPEUTIC AGENTS SMITHKLINE BEECHAM PLC (GB) 2002-01-02 EP claimed
US-5760074-A Treatment SMITHKLINE BEECHAM P.L.C. (GB) 1998-06-02 US claimed
EP-1114821-B1 Benzopyrans and their use as therapeutic agents SMITHKLINE BEECHAM PLC (GB) 2003-09-17 EP disclosed
EP-0764157-B1 BENZOPYRANS AND THEIR USE AS THERAPEUTIC AGENTS SMITHKLINE BEECHAM PLC (GB) 2002-01-02 EP disclosed
EP-1114821-A1 Benzopyrans and their use as therapeutic agents SMITHKLINE BEECHAM PLC (GB) 2001-07-11 EP disclosed
US-5760074-A Treatment SMITHKLINE BEECHAM P.L.C. (GB) 1998-06-02 US disclosed