SCHEMBL5089985

SCHEMBL5089985

C=COC(=O)CC[C@H](N)C(=O)OC=C

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BLM P54132 2/20 0.34
KMT2A Q03164 2/20 0.34
TSHR P16473 2/20 0.34
SLC6A2 P23975 1/20 0.34
SLC6A4 P31645 1/20 0.34
SLC6A3 Q01959 1/20 0.34
MEN1 O00255 1/20 0.34
CYP2D6 P10635 1/20 0.34
NFKB1 P19838 1/20 0.34
CYP2C19 P33261 1/20 0.34
SLC1A1 P43005 2/20 0.33
GRM8 O00222 1/20 0.33
GRM6 O15303 1/20 0.33
GRIN2D O15399 1/20 0.33
GRIN3B O60391 1/20 0.33
GSR P00390 1/20 0.33
CYP1A2 P05177 1/20 0.33
GRIK1 P39086 1/20 0.33
GRM5 P41594 1/20 0.33
GRIA1 P42261 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
SCHEMBL11655301 1.00 BLM (0.34) BLMKMT2ATSHRSLC6A2SLC6A4
Acetic Acid SCHEMBL28783576 0.93 SLC1A1 (0.35) BLMKMT2ATSHRSLC6A2SLC6A4
SCHEMBL3734634 0.93 BLM (0.32) BLMKMT2ATSHRSLC6A2SLC6A4
SCHEMBL6588925 0.85 GRM8 (0.52) BLMKMT2ATSHRSLC6A2SLC6A4
SCHEMBL5089980 0.85 GRIK1 (0.52) BLMKMT2ATSHRSLC6A2SLC6A4
SCHEMBL6588930 0.85 GRM8 (0.52) BLMKMT2ATSHRSLC6A2SLC6A4
SCHEMBL435289 0.82 SLC1A1 (0.34) BLMKMT2ATSHRSLC6A2SLC6A4
SCHEMBL5088902 0.80 TDP1 (0.33) TDP1
SCHEMBL15320710 0.78 ANPEP (0.35) BLMKMT2ATSHRSLC6A2SLC6A4
SCHEMBL15320709 0.78 ANPEP (0.35) BLMKMT2ATSHRSLC6A2SLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080197324-A1 OPHTHALMIC COMPOSITION CONTAINING A POLYOL-ACID COPOLYMER BAUSCH & LOMB INCORPORATED 2008-08-21 US claimed
CN-101163523-B Tooth whitening compositions containing cross-linked polymer-peroxide COLGATE PALMOLIVE CO 2013-06-19 CN disclosed
CN-101163523-A Tooth whitening compositions containing cross-linked polymer-peroxide COLGATE PALMOLIVE CO (US) 2008-04-16 CN disclosed
EP-1315777-B1 DEGRADABLE POLYACETAL POLYMERS AP PHARMA INC (US) 2007-10-31 EP disclosed
US-7220414-B2 Degradable polyacetal polymers A.P. PHARMA, INC. (US) 2007-05-22 US disclosed
EP-1315777-A2 DEGRADABLE POLYACETAL POLYMERS AP Pharma, Inc. (US) 2003-06-04 EP disclosed
CN-1420175-A High-tamp. resistant threonine synthetase gene, polypeptide coded therewith and preparing method thereof HUADA GENE RES & DEV CANTER HA (CN) 2003-05-28 CN disclosed
US-20020082362-A1 Degradable polyacetal polymers HERON THERAPEUTICS, INC. (F/K/A A.P. PHARMA, INC.) 2002-06-27 US disclosed
WO-2002020663-A2 DEGRADABLE POLYACETAL POLYMERS AP PHARMA, INC. (US) 2002-03-14 WO disclosed
US-4107156-A Process for preparing gel polymer of vinyl compound and gel polymer thereof MITSUBISHI RAYON CO., LTD. (JP) 1978-08-15 US disclosed