SCHEMBL7594008

SCHEMBL7594008

NCC(=O)NC(CS)C(=O)NCC(=O)O

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 1/20 0.64
GSTK1 Q9Y2Q3 1/20 0.64
ALDH1A1 P00352 3/20 0.43
MAPT P10636 3/20 0.43
PTGS2 P35354 2/20 0.43
LMNA P02545 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
GLO1 Q04760 2/20 0.40
MME P08473 5/20 0.40
ACE P12821 4/20 0.40
BLM P54132 2/20 0.40
ECE1 P42892 2/20 0.40
HPGD P15428 1/20 0.40
MAPK1 P28482 1/20 0.40
HSD17B10 Q99714 1/20 0.40
MEN1 O00255 1/20 0.40
NPEPPS P55786 1/20 0.40
KMT2A Q03164 1/20 0.40
CPA1 P15085 1/20 0.38
ACE2 Q9BYF1 1/20 0.38

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
SCHEMBL7594016 1.00 PTGS1 (0.64) PTGS1GSTK1ALDH1A1MAPTPTGS2
SCHEMBL30392676 0.97 PTGS1 (0.61) PTGS1GSTK1ALDH1A1MAPTPTGS2
SCHEMBL30062665 0.91 PTGS1 (0.56) PTGS1GSTK1ALDH1A1MAPTPTGS2
SCHEMBL30957417 0.91 PTGS1 (0.56) PTGS1GSTK1ALDH1A1MAPTPTGS2
SCHEMBL31287971 0.87 PTGS1 (0.54) PTGS1GSTK1MAPTPTGS2GLO1
SCHEMBL29567569 0.87 PTGS1 (0.54) PTGS1GSTK1MAPTPTGS2GLO1
SCHEMBL24130565 0.86 PTGS1 (0.48) PTGS1GSTK1ALDH1A1MAPTPTGS2
SCHEMBL24130270 0.86 PTGS1 (0.48) PTGS1GSTK1ALDH1A1MAPTPTGS2
SCHEMBL30834727 0.84 PTGS1 (0.49) PTGS1GSTK1ALDH1A1MAPTPTGS2
SCHEMBL29350894 0.84 PTGS1 (0.47) PTGS1GSTK1ALDH1A1MAPTPTGS2

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
EP-0438600-B2 ENZYMES WHICH PARTICIPATE IN C-TERMINAL AMIDATION, AND PRODUCTION AND USE THEREOF SHISEIDO CO LTD (JP) 2002-10-09 EP disclosed
US-6156555-A Method of preparing an enzyme participating in C-terminal amidation SHISEIDO COMPANY LTD. (JP) 2000-12-05 US disclosed
EP-0666318-B1 Enzyme participating in c-terminal amidation, and method of preparing same and use thereof SHISEIDO CO LTD (JP) 2000-11-29 EP disclosed
US-5871995-A Purified enzymes participating in C-terminal amidation SHISEIDO COMPANY, LTD. (JP) 1999-02-16 US disclosed
EP-0884389-A1 Enzyme participating in C-terminal amidation, and method of preparing same and use thereof SHISEIDO COMPANY LIMITED (JP) 1998-12-16 EP disclosed
EP-0438600-B1 ENZYMES WHICH PARTICIPATE IN C-TERMINAL AMIDATION, AND PRODUCTION AND USE THEREOF SHISEIDO CO LTD (JP) 1996-02-07 EP disclosed
EP-0666318-A1 Enzyme participating in c-terminal amidation, and method of preparing same and use thereof SHISEIDO COMPANY LIMITED (JP) 1995-08-09 EP disclosed
US-5354675-A Amidation of glycine SHISEIDO COMPANY LTD. (JP) 1994-10-11 US disclosed
EP-0447547-B1 C-TERMINUS AMIDATION ENZYME COMPOSITION, PROCESS FOR ITS PREPARATION AND ITS USE SHISEIDO CO LTD (JP) 1994-07-27 EP disclosed
EP-0447547-A1 C-TERMINUS AMIDATION ENZYME COMPOSITION, PROCESS FOR ITS PREPARATION AND ITS USE SHISEIDO COMPANY LIMITED (JP) 1991-09-25 EP disclosed
EP-0438600-A1 ENZYMES WHICH PARTICIPATE IN C-TERMINAL AMIDATION, AND PRODUCTION AND USE THEREOF SHISEIDO COMPANY LIMITED (JP) 1991-07-31 EP disclosed