SCHEMBL7561870

SCHEMBL7561870

CC(O)C(C)(C)OC(C)(C)C(C)O

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.35
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33

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
SCHEMBL8043484 0.79 MAPK1 (0.35) MAPK1ALDH1A1LMNA
SCHEMBL10495920 0.79
SCHEMBL8211972 0.76
SCHEMBL28636429 0.73 MAPK1 (0.32) MAPK1
SCHEMBL2023935 0.71 TSHR (0.47) MAPK1ALDH1A1
Water SCHEMBL28814625 0.71
SCHEMBL13270232 0.71 MAPK1 (0.31) MAPK1
SCHEMBL263071 0.69
SCHEMBL10704952 0.69 MAPK1 (0.35) MAPK1
SCHEMBL30366434 0.69

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1229026-A1 ALKOXYIMINOALKANOIC ACID DERIVATIVES Takeda Chemical Industries, Ltd. (JP) 2002-08-07 EP disclosed
US-6346521-B1 OSTEOGENESIS PROMOTERS FOR BONE DISORDERS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2002-02-12 US disclosed
EP-0719258-B1 CYCLIC AMIDE DERIVATIVES FOR PROTECTING AGAINST ULTRAVIOLET RAYS OTSUKA PHARMA CO LTD (JP) 2001-10-31 EP disclosed
EP-0719782-B1 Optically active benzothiepin derivative, its preparation and use TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2001-07-04 EP disclosed
US-5786367-A OXYGEN SCAVENGERS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1998-07-28 US disclosed
EP-0719782-A1 Optically active benzothiepin derivative, its preparation and use TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1996-07-03 EP disclosed
EP-0483772-B1 Aminocoumaran derivatives, their production and use TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1995-09-13 EP disclosed
EP-0483772-A1 Aminocoumaran derivatives, their production and use TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1992-05-06 EP disclosed
US-4914109-A ANTICONVULSANTS, ANTIANXIETY AGENTS A. H. ROBINS COMPANY, INCORPORATED (US) 1990-04-03 US disclosed
US-4892872-A ANTIEMETICS, ANTINAUSEA YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1990-01-09 US disclosed
US-4824951-A MUSCLE RELAXANTS, ANTICONVULSANTS, ANXIOLYTIC AGENTS A. H. ROBINS COMPANY, INCORPORATED (US) 1989-04-25 US disclosed
US-4772600-A MUSCLE RELAXANTS, ANTICONVULSANTS, ANXIOLYTIC A. H. ROBINS COMPANY, INC. (US) 1988-09-20 US disclosed
US-4649144-A Antibacterial 7-(3-amino-1-pyrrolidinyl)-1-cyclopropyl-6-fluoro-1,4-dihydro-4-oxo-1,8-naphthyridine-3-carboxylic acid derivatives DAINIPPON PHARMACEUTICAL CO., LTD. (JP) 1987-03-10 US disclosed
US-4202895-A 1-Polyhaloalkyl-2(1H)-quinazolinone derivatives SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1980-05-13 US disclosed
US-4182706-A Flame-retardant agents for phenolic resins and process for their production CHEMISCHE FABRIK KALK GMBH (DE) 1980-01-08 US disclosed
US-4107188-A FOR DECREASING LIPID LEVELS HOFFMANN-LA ROCHE INC. (US) 1978-08-15 US disclosed
US-4105768-A Hypotensive substituted 1,2,4-triazoles ASTRA LAKEMEDEL AKTIEBOLAG (SE) 1978-08-08 US disclosed
US-4104285-A OF NORCHOLANIC ACID, BISNORCHOLANIC ACID, OR ETIOCHOLANIC ACID, STEROIDS, BILE FLOW STIMULATORS, ANTILIPEMIC AGENTS HOFFMANN-LA ROCHE INC. (US) 1978-08-01 US disclosed
US-3959476-A Antihypertensive substituted triazoles ASTRA LAKEMEDEL AKTIEBOLAG (SW) 1976-05-25 US disclosed