SCHEMBL6756458

SCHEMBL6756458

O=C(O)N(CCN(C(=O)O)C(=O)O)C(=O)O.[Na].[Na]

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.35
EYA2 O00167 1/20 0.35
APP P05067 1/20 0.35
ACE P12821 1/20 0.35
KDM4E B2RXH2 1/20 0.33
LMNA P02545 1/20 0.33
CHRM2 P08172 1/20 0.33
ADRA2A P08913 1/20 0.33
ALOX15 P16050 1/20 0.33
TSHR P16473 1/20 0.33
DRD1 P21728 1/20 0.33
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33
CYP2C19 P33261 1/20 0.33
ADRA1A P35348 1/20 0.33
DRD3 P35462 1/20 0.33
BLM P54132 1/20 0.33
PMP22 Q01453 1/20 0.33
SLC6A3 Q01959 1/20 0.33
HRH3 Q9Y5N1 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
SCHEMBL31662731 1.00 TDP1 (0.35) TDP1EYA2APPACEKDM4E
Magnesium SCHEMBL3108011 0.96 TDP1 (0.33) TDP1EYA2APPACEKDM4E
SCHEMBL11788787 0.86 TDP1 (0.32) TDP1EYA2APPACEKDM4E
SCHEMBL8873969 0.83 EYA2 (0.30) TDP1EYA2APPACE
SCHEMBL28428366 0.81 TDP1 (0.33) TDP1EYA2APPACEKDM4E
SCHEMBL25259073 0.79 MAPT (0.35) TDP1EYA2APPACEKDM4E
SCHEMBL4868996 0.79 TSHR (0.35) TDP1EYA2APPACEKDM4E
SCHEMBL9013835 0.76 TDP1 (0.70) TDP1EYA2APPACEKDM4E
SCHEMBL28642536 0.76 GLRA1 (0.37) TDP1EYA2APPACELMNA
SCHEMBL10897683 0.76 CA12 (0.42) TDP1LMNAALOX15TSHRADRA1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040018143-A1 Hydrogen peroxide production using catalyst particles with controlled surface coordination number HYDROCARBON TECHNOLOGIES INC. 2004-01-29 US claimed
US-11352449-B2 Graft copolymer, and thermoplastic resin composition using same TECHNO-UMG CO., LTD. (JP) 2022-06-07 US disclosed
US-20200317920-A1 METHOD OF PRODUCING A RUBBERY POLYMER TECHNO UMG CO LTD (JP) 2020-10-08 US disclosed
US-20180312693-A1 GRAFT COPOLYMER, CROSSLINKED PARTICLES, GRAFT CROSSLINKED PARTICLES, RUBBERY POLYMER, AND THERMOPLASTIC RESIN COMPOSITION USING SAME TECHNO-UMG CO., LTD. (JP) 2018-11-01 US disclosed
EP-3369755-A1 GRAFT COPOLYMER, CROSSLINKED PARTICLES, GRAFT CROSSLINKED PARTICLES, RUBBERY POLYMER AND THERMOPLASTIC RESIN COMPOSITION USING SAME UMG ABS, Ltd. (JP) 2018-09-05 EP disclosed
US-4992427-A 2-substituted inosines and their use as antiviral agents UNIVERSITY OF IOWA RESEARCH FOUNDATION (US) 1991-02-12 US disclosed