SCHEMBL4112988

SCHEMBL4112988

COc1cccc([C@H]2O[C@H](CC(=O)NCCN3CCCC3)C(=O)N(CC(C)(C)CO)c3ccc(Cl)cc32)c1OC

nearest known ligand 0.80

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
FDFT1 P37268 18/20 0.80

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
SCHEMBL4119124 0.95 FDFT1 (0.73) FDFT1
SCHEMBL4105280 0.94 FDFT1 (0.71) FDFT1
SCHEMBL4685905 0.88 FDFT1 (0.82) FDFT1
SCHEMBL7250136 0.88 FDFT1 (0.90) FDFT1
SCHEMBL7255888 0.88 FDFT1 (1.00) FDFT1
SCHEMBL7254399 0.87 FDFT1 (0.90) FDFT1
SCHEMBL7248923 0.87 FDFT1 (1.00) FDFT1
SCHEMBL4679220 0.87 FDFT1 (0.61) FDFT1
SCHEMBL7256146 0.86 FDFT1 (0.89) FDFT1
SCHEMBL7250335 0.86 FDFT1 (0.99) 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 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1097928-B1 5-(2,3-Dialkoxyphenyl)-4,1-benzoxazepin-2-ones as anti-hyperlipidemics TAKEDA PHARMACEUTICAL (JP) 2008-07-16 EP claimed
US-20040063750-A1 High-density lipoprotein-cholesterol level elevating agent TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2004-04-01 US claimed
EP-1332763-A1 HIGH-DENSITY LIPOPROTEIN-CHOLESTEROL LEVEL ELEVATING AGENT Takeda Chemical Industries, Ltd. (JP) 2003-08-06 EP claimed
EP-0862562-B1 BENZOXAZEPINE COMPOUNDS, THEIR PRODUCTION AND USE AS LIPID LOWERING AGENTS TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2001-07-04 EP claimed
US-6110909-A SQUALENE SYNTHETASE INHIBITING ANTILIPEMIC AGENTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2000-08-29 US claimed
US-20090209510-A1 Novel Method of Treating Hyperlipidemia TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-08-20 US disclosed
US-20090118255-A1 Crp Lowering Agent TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-05-07 US disclosed
US-20090082333-A1 REMEDY FOR XANTHOMA NATIONAL UNIVERSITY CORPORATION KOBE UNIVERSITY (JP) 2009-03-26 US disclosed
US-20080113965-A1 Compound having inhibitory activity against squalene synthase or a salt or prodrug thereof, for example, N-[[(3R,5S)-1-(3-acetoxy-2,2-dimethylpropyl)-7-chloro-5-(2,3-dimethoxyphenyl)-2-oxo-1,2,3,5-tetrahydro-4,1-benzoxazepin-3-yl]acetyl]piperidine-4-acetic acid; myalgia or rhabdomyolysis treatment TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-05-15 US disclosed
US-20080058310-A1 High-density lipoprotein-cholesterol level elevating agent TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-03-06 US disclosed
EP-1889632-A1 REMEDY FOR XANTHOMA National University Corp. Kobe University (JP) 2008-02-20 EP disclosed
US-20060052362-A1 Skeletal muscle protecting agent TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-03-09 US disclosed
EP-1600166-A1 SKELETAL MUSCLE PROTECTING AGENT Takeda Pharmaceutical Company Limited (JP) 2005-11-30 EP disclosed
US-20040063750-A1 High-density lipoprotein-cholesterol level elevating agent TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2004-04-01 US disclosed
EP-1332763-A1 HIGH-DENSITY LIPOPROTEIN-CHOLESTEROL LEVEL ELEVATING AGENT Takeda Chemical Industries, Ltd. (JP) 2003-08-06 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (7 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090082333-A1 REMEDY FOR XANTHOMA FDFT1, LSS, SQLE FDFT1 1/4885
US-20080058310-A1 High-density lipoprotein-cholesterol level elevating agent SREBF1, SREBF2, HDLBP FDFT1 10/4885
US-20090118255-A1 Crp Lowering Agent SPR, RBP1, HMGCR FDFT1 7/4885
US-20090209510-A1 Novel Method of Treating Hyperlipidemia HMGCR, LIPC, LIPA FDFT1 12/4885
US-20080113965-A1 Compound having inhibitory activity against squalene synthase or a salt or prodrug thereof, for example, N-[[(3R,5S)-1-(3-acetoxy-2,2-dimethylpropyl)-7-chloro-5-(2,3-dimethoxyphenyl)-2-oxo-1,2,3,5-tetrahydro-4,1-benzoxazepin-3-yl]acetyl]piperidine-4-acetic acid; myalgia or rhabdomyolysis treatment SQLE, DHPS, COASY FDFT1 13/4885
US-20060052362-A1 Skeletal muscle protecting agent GYS1, CPT1B, TNNC1 FDFT1 8/4885
US-20040063750-A1 High-density lipoprotein-cholesterol level elevating agent SREBF1, SREBF2, HDLBP FDFT1 10/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.