SCHEMBL6614533

SCHEMBL6614533

OCCC[N+]12CCN(CC1)CC2

nearest known ligand 0.36

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PTK2 Q05397 1/20 0.36

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
Bromide SCHEMBL8781322 0.98 PTK2 (0.34) PTK2
SCHEMBL4903183 0.84 PTK2 (0.50) PTK2
SCHEMBL3483406 0.84
Bromide SCHEMBL16968721 0.81
Bromide SCHEMBL3484126 0.81
Water SCHEMBL31310133 0.81
SCHEMBL31390182 0.79
Bromide SCHEMBL19514188 0.79
Bromide SCHEMBL30975312 0.73
SCHEMBL4899536 0.73 PTK2 (0.31) PTK2

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 48 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0906313-B1 CARBAPENEM ANTIBACTERIAL COMPOUNDS, COMPOSITIONS CONTAINING SUCH COMPOUNDS AND METHODS OF TREATMENT MERCK & CO INC (US) 2004-03-03 EP disclosed
EP-1089999-A4 (HETEROCYCLIC) METHYL SUBSTITUTED CARBAPENEM ANTIBACTERIALS MERCK & CO INC (US) 2002-12-04 EP disclosed
US-6489471-B1 A PROCESS OF SYNTHESIZING A CARBAPENEM COMPOUND OF FORMULA (6) IS DISCLOSED, WHEREIN R REPRESENTS H OR METHYL, P AND P* INDEPENDENTLY REPRESENT H OR PROTECTING GROUPS AND EACH R.SUP.1 IS INDEPENDENTLY SELECTED FROM: H, HALO, OH, OP MERCK & CO., INC. 2002-12-03 US disclosed
EP-1090000-A4 NAPHTHO 1,8-DE]THIASIN-2-YL METHYL CARBAPENEM ANTIBACTERIALS MERCK & CO INC (US) 2002-11-27 EP disclosed
EP-1090001-A4 (HETEROCYCLIC)METHYL SUBSTITUTED CARBAPENEM ANTIBACTERIALS MERCK & CO INC (US) 2002-11-27 EP disclosed
EP-1023293-A4 ARYLOXYMETHYL CARBAPENEM ANTIBACTERIALS MERCK & CO INC (US) 2002-11-20 EP disclosed
EP-1089729-A4 CARBAPENEM ANTIBACTERIAL COMPOUNDS, COMPOSITIONS CONTAINING SUCH COMPOUNDS AND METHODS OF TREATMENT MERCK & CO INC (US) 2002-11-06 EP disclosed
US-6346525-B1 CARBAPENICILLIN WITH 1,1-DIOXO-2H-1-THIA-2,3-DIAZA-NAPHTHALENE SUBSTITUENT; TREATING STAPHYLOCOCCUS INFECTIONS RESISTANT TO METHICILLIN; SIDE EFFECT REDUCTION MERCK & CO., INC. 2002-02-12 US disclosed
US-6346526-B1 CARBAPENICILLIN WITH 1,1-DIOXO-2,3-DIHYDRONAPHTHO(1,8-DE)(1,2)THIAZIN-2-YL-SUBSTITUENT; TREATING STAPHYLOCOCCUS INFECTIONS RESISTANT TO METHICILLIN; SIDE EFFECT REDUCTION MERCK & CO., INC. 2002-02-12 US disclosed
EP-1104424-A4 PROCESS FOR THE SYNTHESIS OF CARBAPENEM INTERMEDIATES, AND COMPOUNDS PRODUCED MERCK & CO INC (US) 2002-01-23 EP disclosed
US-5994343-A ANTIBIOTICS MERCK & CO., INC. (US) 1999-11-30 US disclosed
WO-1999020270-A1 CARBAPENEM ANTIBACTERIAL COMPOUNDS, COMPOSITIONS AND METHODS OF TREATMENT MERCK & CO., INC. (US) 1999-04-29 WO disclosed
WO-1999018107-A1 CARBAPENEM ANTIBACTERIAL COMPOUNDS, COMPOSITIONS CONTAINING SUCH COMPOUNDS AND METHODS OF TREATMENT MERCK & CO., INC. (US) 1999-04-15 WO disclosed
WO-1999014217-A1 ARYLOXYMETHYL CARBAPENEM ANTIBACTERIALS MERCK & CO., INC. (US) 1999-03-25 WO disclosed
WO-1999012928-A1 3-(IODOPHENOXYMETHYL) CARBAPENEM ANTIBACTERIALS MERCK & CO., INC. (US) 1999-03-18 WO disclosed
WO-1998051677-A1 PROCESS FOR SYNTHESIZING CARBAPENEM INTERMEDIATES MERCK & CO., INC. (US) 1998-11-19 WO disclosed
EP-0750620-A4 CARBAPENEM COMPOUNDS, COMPOSITIONS AND METHODS OF TREATMENT MERCK & CO INC (US) 1997-07-16 EP disclosed
EP-0750620-A1 CARBAPENEM COMPOUNDS, COMPOSITIONS AND METHODS OF TREATMENT MERCK & CO. INC. (US) 1997-01-02 EP disclosed
US-5496816-A Carbapenem antibacterial compounds, compositions containing such compounds and methods of treatment MERCK & CO., INC. (US) 1996-03-05 US disclosed
WO-1995025108-A1 CARBAPENEM COMPOUNDS, COMPOSITIONS AND METHODS OF TREATMENT MERCK & CO., INC. (US) 1995-09-21 WO disclosed