SCHEMBL628091

SCHEMBL628091

C=CC[N]C(=O)O

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL6190437 0.77
SCHEMBL9351180 0.76 ALOX15 (0.43)
SCHEMBL11030650 0.74
SCHEMBL9603476 0.74
SCHEMBL31385 0.74
SCHEMBL594094 0.74
SCHEMBL4960693 0.74
SCHEMBL251766 0.74
SCHEMBL4254567 0.70
SCHEMBL7359482 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 234 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2103658-B1 Ink jet ink, ink jet recording method, ink cartridge, recording unit, and ink jet recording apparatus CANON KK (JP) 2013-09-18 EP claimed
EP-2291291-B1 INK JET RECORDING SHEET USEFUL AS TRANSFER SUBSTRATE APPLETON PAPER INC (US) 2013-06-05 EP claimed
EP-2448895-B1 CONTINUOUS METHOD FOR THE HYDROGENATION OF AROMATIC COMPOUNDS AET GROUP (FR) 2013-05-01 EP claimed
CN-102917590-A Trycyclic compounds and pbk inhibitors containing the same ONCOTHERAPY SCIENCE INC 2013-02-06 CN claimed
CN-102741241-A Benzimidazole-imidazole derivatives TIBOTEC PHARM LTD 2012-10-17 CN claimed
US-20120172632-A1 CONTINUOUS METHOD FOR THE HYDROGENATION OF AROMATIC COMPOUNDS AET GROUP (FR) 2012-07-05 US claimed
CN-102482260-A Bis-benzimidazole derivatives TIBOTEC PHARM LTD 2012-05-30 CN claimed
EP-2448895-A1 CONTINUOUS METHOD FOR THE HYDROGENATION OF AROMATIC COMPOUNDS Aet Group (FR) 2012-05-09 EP claimed
CN-102448952-A Antiviral compounds and uses thereof ABBOTT LAB 2012-05-09 CN claimed
CN-102448920-A Antiviral compounds and uses thereof ABBOTT LAB 2012-05-09 CN claimed
EP-0171636-A1 Pharmacologically active piperazino derivatives and the process for their preparation RAVIZZA S.p.A. (IT) 1986-02-19 EP claimed
EP-0055562-B1 CEPHALOSPORIN DERIVATIVES ICI PHARMA (FR) 1986-02-12 EP claimed
US-4492692-A BACTERICIDE IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1985-01-08 US claimed
EP-0055099-B1 PENICILLIN DERIVATIVES ICI PHARMA (FR) 1984-10-24 EP claimed
EP-0075434-A2 Cephalosporins, their preparation and their pharmaceutical compositions ICI PHARMA (FR) 1983-03-30 EP claimed
EP-0071370-A2 Cephalosporin derivatives, process for their preparation and pharmaceutical compositions containing them ICI PHARMA (FR) 1983-02-09 EP claimed
EP-0055099-A1 Penicillin derivatives ICI PHARMA (FR) 1982-06-30 EP claimed
US-4319910-A POLYOXYETHYLENE GLYCOLS AND TRACE ELEMENTS IN THE FORM OF CHELATE COMPOUNDS HOECHST AKTIENGESELLSCHAFT (DE) 1982-03-16 US claimed
US-4308147-A Composition and treating aqueous solutions with N-carboxy alkyl amino alkane polyphosphonic acids and their alkali metal salts BENCKISER-KNAPSACK GMBH (DE) 1981-12-29 US claimed
US-4307038-A N-Carboxy alkyl amino alkane polyphosphonic acids BENCKISER-KNAPSACK GMBH (DE) 1981-12-22 US claimed