SCHEMBL8213852

SCHEMBL8213852

NCC(=O)NCC(=O)NCC(=O)N[C@@H](CC(N)=O)C(=O)NCC(=O)NCC(=O)N[C@@H](CC(N)=O)C(=O)NCC(=O)NCC(=O)O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 1/20 0.41
GSTK1 Q9Y2Q3 1/20 0.41
GLO1 Q04760 1/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
ITGB3 P05106 4/20 0.34
ITGB1 P05556 3/20 0.34
ITGAV P06756 3/20 0.34
ITGA5 P08648 3/20 0.34
MDM4 O15151 1/20 0.34
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.34
MAPT P10636 1/20 0.34
PTGS2 P35354 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
ECE1 P42892 4/20 0.34
TERT O14746 1/20 0.34
MDM2 Q00987 2/20 0.33
GRIA1 P42261 1/20 0.33
GRIA3 P42263 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
SCHEMBL6757860 1.00 PTGS1 (0.41) PTGS1GSTK1GLO1MEN1KMT2A
SCHEMBL6675010 1.00 PTGS1 (0.41) PTGS1GSTK1GLO1MEN1KMT2A
SCHEMBL7257306 1.00 PTGS1 (0.41) PTGS1GSTK1GLO1MEN1KMT2A
SCHEMBL8214832 1.00 PTGS1 (0.41) PTGS1GSTK1GLO1MEN1KMT2A
SCHEMBL7571368 1.00 PTGS1 (0.41) PTGS1GSTK1GLO1MEN1KMT2A
SCHEMBL8436887 1.00 PTGS1 (0.41) PTGS1GSTK1GLO1MEN1KMT2A
SCHEMBL6130183 1.00 PTGS1 (0.41) PTGS1GSTK1GLO1MEN1KMT2A
SCHEMBL18396457 1.00 PTGS1 (0.41) PTGS1GSTK1GLO1MEN1KMT2A
SCHEMBL6823837 1.00 PTGS1 (0.41) PTGS1GSTK1GLO1MEN1KMT2A
SCHEMBL7576676 1.00 PTGS1 (0.41) PTGS1GSTK1GLO1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101903524-A Pathogen control genes and methods of use in plants BASF PLANT SCIENCE GMBH 2010-12-01 CN disclosed
CN-1298848-C Analog of haemophilus Hin47 with reduced protease activity CONNAUGHT LAB (CA) 2007-02-07 CN disclosed
US-6153580-A FOR GENERATING AN IMMUNE RESPONSE IN HOST LOOSMORE SHEENA M (CA) 2000-11-28 US disclosed
US-6147057-A IMMUNOGENIC COMPOSITION CONNAUGHT LABORATORIES LIMITED (CA) 2000-11-14 US disclosed
US-6114125-A DETECTION BACTERIAL PARASITE POLYPEPTIDE IN SAMPLE; IMMUNIZING A MAMMAL, ISOLATING ANTIBODIES, INCUBATING SAMPLE WITH ANTIBODIES, DETECTING COMPLEXES CONNAUGHT LABORATORIES LIMITED (CA) 2000-09-05 US disclosed
US-6025342-A Analog of Haemophilus Hin47 with reduced protease activity CONNAUGHT LABORATORIES LIMITED (CA) 2000-02-15 US disclosed
US-6020183-A Analog of haemophilus Hin47 with reduced protease activity CONNAUGHT LABORATRIES LIMITED (CA) 2000-02-01 US disclosed
US-5980907-A USE IN IMMUNOPROPHYLAXIS GLAXO WELLCOME INC. (US) 1999-11-09 US disclosed
US-5981503-A EFFECTING SITE-DIRECTED MUTAGENESIS OF THE HIN47 GENE TO REMOVE OR REPLACE A NUCLEOTIDE SEQUENCE ENCODING ATLEAST ONE AMINO ACID AND PRODUCE A MUTATED HAEMOPHILUS INFUENZA HIN 47, INTRODUCING TO THE CELL FOR GROWING A TRANSFORMED CELL CONNAUGHT LABORATORIES LIMITED (CA) 1999-11-09 US disclosed
CN-1136328-A Haemophilus Hin47 analogs with reduced protease activity CONNAUGHT LAB (US) 1996-11-20 CN disclosed
US-5457046-A Polypeptides NOVO NORDISK A/S (DK) 1995-10-10 US disclosed