SCHEMBL6380772

SCHEMBL6380772

CCC(CCO)[N+](=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
SCHEMBL11417385 0.80 ALDH1A1 (0.38)
SCHEMBL635418 0.80
SCHEMBL1118146 0.80
SCHEMBL3114905 0.80
SCHEMBL1170405 0.79
Ethane SCHEMBL27863509 0.78 ALDH1A1 (0.42)
Methyl Alcohol SCHEMBL14764243 0.78 ALDH1A1 (0.42)
SCHEMBL11007614 0.77 LMNA (0.42)
SCHEMBL1170561 0.76 ALDH1A1 (0.42)
SCHEMBL2799546 0.76

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0976734-B1 Selective inhibitors of viral or bacterial neuraminidase GILEAD SCIENCES INC (US) 2005-09-28 EP disclosed
US-20050176758-A1 2-(hydroxy or methoxymethoxy)-4-(carboxy or alkoxycarbonyl)-5-(fluoro or hydrogen)-7-oxabicyclo(4.1.0)hept-3-ene chemical intermediates to neuraminidase inhibitors GILEAD SCIENCES, INC. 2005-08-11 US disclosed
US-6225341-B1 FOR INHIBITING NEURAMINIDASE; FOR THERAPY AND PROPHYLAXIS OF VIRUS INFECTION GILEAD SCIENCES, INC. 2001-05-01 US disclosed
EP-0759917-B1 NOVEL SELECTIVE INHIBITORS OF VIRAL OR BACTERIAL NEURAMINIDASES GILEAD SCIENCES INC (US) 2000-04-12 EP disclosed
WO-1996026933-A9 NOVEL SELECTIVE INHIBITORS OF VIRAL OR BACTERIAL NEURAMINIDASES 1996-11-28 WO disclosed
US-4342711-A EXTRUDING A SPINNING SOLUTION OF POLYMER AND SOLVENT AROUND A STREAM OF SOLVENT AND SWELLING LIQUID; INTO AN AQUEOUS BATH HIGH SPEED NIPPON ZEON CO., LTD. (JP) 1982-08-03 US disclosed
US-4323627-A CONTROLLED HYDROLYSI USING ALKALI OR ACID NIPPON ZEON CO., LTD. (JP) 1982-04-06 US disclosed
US-4322381-A Method of manufacturing hollow fiber NIPPON ZEON CO., LTD. (JP) 1982-03-30 US disclosed