SCHEMBL3980455

SCHEMBL3980455

c1coc(-c2ncco2)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 10/20 0.48
KDM4E B2RXH2 9/20 0.48
NPC1 O15118 8/20 0.48
RAB9A P51151 8/20 0.48
HSD17B10 Q99714 8/20 0.48
HPGD P15428 7/20 0.48
MAPT P10636 5/20 0.48
POLB P06746 4/20 0.48
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
PKM P14618 3/20 0.48
ALOX15 P16050 2/20 0.48
CASP1 P29466 2/20 0.48
PTPN7 P35236 2/20 0.48
RECQL P46063 2/20 0.48
BLM P54132 2/20 0.48
CASP7 P55210 2/20 0.48
TDP1 Q9NUW8 2/20 0.48
L3MBTL1 Q9Y468 2/20 0.48
USP2 O75604 1/20 0.48

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
Isoxazole SCHEMBL27896201 0.87 PARP1 (0.45) ALDH1A1KDM4ENPC1RAB9AHSD17B10
SCHEMBL28928829 0.82 BRD4 (0.43) ALDH1A1KDM4ENPC1RAB9AHSD17B10
SCHEMBL3263841 0.82 RAB9A (0.63) ALDH1A1KDM4ENPC1RAB9AHSD17B10
SCHEMBL100765 0.74 HPGDS (0.46) HPGDSLTA4H
SCHEMBL31064873 0.71 ALDH1A1 (0.65) ALDH1A1KDM4ENPC1RAB9AHSD17B10
SCHEMBL5259444 0.71 POLB (0.65) ALDH1A1KDM4ENPC1RAB9AHSD17B10
SCHEMBL1919495 0.71 HPGDS (0.52) HPGDSLTA4H
SCHEMBL28315169 0.71
SCHEMBL19528998 0.71 NOTUM (0.41) ALDH1A1KDM4ENPC1RAB9AHSD17B10
SCHEMBL1799678 0.71 ALDH1A1 (0.63) ALDH1A1KDM4ENPC1RAB9AHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3233080-A1 COMPOSITIONS AND METHODS FOR IMPROVING AGRONOMIC CHARACTERISTICS OF PLANTS Monsanto Technology LLC (US) 2017-10-25 EP disclosed
WO-2016100766-A1 COMPOSITIONS AND METHODS FOR IMPROVING AGRONOMIC CHARACTERISTICS OF PLANTS MONSANTO TECHNOLOGY LLC (US) 2016-06-23 WO disclosed
EP-1765821-A4 GRAM-POSITIVE CARBAPENEM ANTIBACTERIALS AND PROCESSES FOR THEIR PREPARATION FOB SYNTHESIS INC (US) 2009-05-20 EP disclosed
EP-1765821-A2 GRAM-POSITIVE CARBAPENEM ANTIBACTERIALS AND PROCESSES FOR THEIR PREPARATION FOB Synthesis, Inc. (US) 2007-03-28 EP disclosed
WO-2005123069-A2 GRAM-POSITIVE CARBAPENEM ANTIBACTERIALS AND PROCESSES FOR THEIR PREPARATION FOB SYNTHESIS, INC. (US) 2005-12-29 WO disclosed
EP-1089999-A4 (HETEROCYCLIC) METHYL SUBSTITUTED CARBAPENEM ANTIBACTERIALS MERCK & CO INC (US) 2002-12-04 EP 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-1003747-A4 CARBAPENEMS WITH NAPHTHOSULTAM DERIVATIVE LINKED VIA METHYLENE MERCK & CO INC (US) 2002-11-06 EP disclosed
US-5773227-A CHELATE COMPOUNDS, FLUORESCENT INDICATOR AND TARGET PEPTIDES MOLECULAR PROBES, INC. (US) 1998-06-30 US disclosed
WO-1998011108-A1 CARBAPENEM ANTIBACTERIAL COMPOUNDS, COMPOSITIONS CONTAINING SUCH COMPOUNDS AND METHODS OF TREATMENT MERCK & CO., INC. (US) 1998-03-19 WO disclosed
WO-1998010761-A1 CARBAPENEM ANTIBACTERIAL COMPOUNDS, COMPOSITIONS CONTAINING SUCH COMPOUNDS AND METHODS OF TREATMENT MERCK & CO., INC. (US) 1998-03-19 WO disclosed
WO-1997040048-A1 CARBAPENEM ANTIBACTERIAL COMPOUNDS, COMPOSITIONS CONTAINING SUCH COMPOUNDS AND METHODS OF TREATMENT MERCK & CO., INC. (US) 1997-10-30 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-5453517-A Covalently attached to fluorophores and/or polymers; detoxify excess metals, in vitro buffers, optical indicators of ionic transients MOLECULAR PROBES, INC. (US) 1995-09-26 US disclosed
WO-1995025108-A1 CARBAPENEM COMPOUNDS, COMPOSITIONS AND METHODS OF TREATMENT MERCK & CO., INC. (US) 1995-09-21 WO disclosed
EP-0399645-B1 Tetrahydropyranyl derivatives, process for their preparation and pharmaceutical or veterinary compositions containing them BEECHAM GROUP PLC (GB) 1994-11-09 EP disclosed
EP-0399645-A2 Tetrahydropyranyl derivatives, process for their preparation and pharmaceutical or veterinary compositions containing them BEECHAM GROUP PLC (GB) 1990-11-28 EP disclosed