SCHEMBL6954451

SCHEMBL6954451

CN1C(=O)C(CCC(=O)O)OC(c2ccccc2Cl)c2cc(Cl)ccc21

nearest known ligand 0.51

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
FDFT1 P37268 6/20 0.43
EGFR P00533 1/20 0.41
MDM2 Q00987 2/20 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
SCHEMBL6953652 0.90 FDFT1 (0.52) FDFT1MDM2
SCHEMBL6953662 0.90 FDFT1 (0.52) FDFT1MDM2
SCHEMBL6953659 0.90 FDFT1 (0.52) FDFT1MDM2
SCHEMBL6954784 0.86 FDFT1 (0.47) FDFT1
SCHEMBL6954772 0.86 FDFT1 (0.47) FDFT1
SCHEMBL6954779 0.86 FDFT1 (0.47) FDFT1
SCHEMBL6955271 0.86 FDFT1 (0.47) FDFT1
SCHEMBL6955260 0.86 FDFT1 (0.47) FDFT1
SCHEMBL6961890 0.85 FDFT1 (0.53) FDFT1
SCHEMBL6961879 0.85 FDFT1 (0.53) FDFT1

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
EP-0567026-B1 4,1-Benzoxazepin derivatives as squalene synthase inhibitors and their use in the treatment of hypercholesteremia and as fungicides TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2003-03-26 EP disclosed
US-5885979-A SQUALENE SYNTHETASE INHIBITOR TREATING OR PREVENTING HYPERLIPIDEMIA TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1999-03-23 US disclosed
US-5726306-A INHIBITORS OF SQUALENE SYNTHETASE AND FUNGAL GROWTH; USEFUL IN TREATING AND PREVENTING HYPERLIPIDEMIA TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1998-03-10 US disclosed
EP-0567026-A1 4,1-Benzoxazepin derivatives as squalene synthase inhibitors and their use in the treatment of hypercholesteremia and as fungicides TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1993-10-27 EP disclosed