Zinc Ion

Zinc Ion

SCHEMBL258486

CCCCCCCCCC(C(=O)[O-])N1C(=O)C=CC1=O.CCCCCCCCCC(C(=O)[O-])N1C(=O)C=CC1=O.[Zn+2]

nearest known ligand 0.45

Full drug profile on Sugi Atlas →

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.45
CA1 P00915 2/20 0.43
MGLL Q99685 4/20 0.42
PTGS1 P23219 3/20 0.42
PTGS2 P35354 3/20 0.42
FAAH O00519 2/20 0.42
GPR84 Q9NQS5 4/20 0.38
LMNA P02545 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
FFAR1 O14842 1/20 0.36
NFKB1 P19838 1/20 0.36
MAPT P10636 1/20 0.35
LCK P06239 1/20 0.35
PPARD Q03181 1/20 0.35
ZDHHC20 Q5W0Z9 1/20 0.35
ZDHHC2 Q9UIJ5 1/20 0.35
ALDH1A1 P00352 1/20 0.35
CYP2C19 P33261 1/20 0.35

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
SCHEMBL258605 0.97 CA2 (0.45) CA2CA1MGLLPTGS1PTGS2
Acrylic Acid SCHEMBL258362 0.92 CA2 (0.39) CA2CA1MGLLPTGS1PTGS2
Acrylic Acid SCHEMBL258364 0.89 CA2 (0.39) CA2CA1MGLLPTGS1PTGS2
Acrylic Acid SCHEMBL258661 0.85 CA2 (0.35) CA2CA1MGLLPTGS1PTGS2
SCHEMBL6940135 0.84 GPR84 (0.46) MGLLPTGS1PTGS2FAAHGPR84
SCHEMBL30634818 0.84 GPR84 (0.46) MGLLPTGS1PTGS2FAAHGPR84
SCHEMBL1574549 0.84 GPR84 (0.46) MGLLPTGS1PTGS2FAAHGPR84
SCHEMBL6934782 0.84 GPR84 (0.46) MGLLPTGS1PTGS2FAAHGPR84
SCHEMBL43883 0.84 GPR84 (0.46) MGLLPTGS1PTGS2FAAHGPR84
Hydrochloric Acid SCHEMBL6934814 0.83 GPR84 (0.44) MGLLPTGS1PTGS2FAAHGPR84

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-8063161-B2 Low temperature curing acrylate and maleimide based formulations and methods for use thereof DESIGNER MOLECULES, INC. (US) 2011-11-22 US claimed
US-20100063184-A1 LOW TEMPERATURE CURING ACRYLATE AND MALEIMIDE BASED FORMULATIONS AND METHODS FOR USE THEREOF DESIGNER MOLECULES, INC. (US) 2010-03-11 US claimed
WO-2008130894-A1 LOW TEMPERATURE CURING ACRYLATE AND MALEIMIDE BASED FORMULATIONS AND METHODS FOR USE THEREOF DESIGNER MOLECULES, INC. (US) 2008-10-30 WO claimed
US-8063161-B2 Low temperature curing acrylate and maleimide based formulations and methods for use thereof DESIGNER MOLECULES, INC. (US) 2011-11-22 US disclosed
US-20100063184-A1 LOW TEMPERATURE CURING ACRYLATE AND MALEIMIDE BASED FORMULATIONS AND METHODS FOR USE THEREOF DESIGNER MOLECULES, INC. (US) 2010-03-11 US disclosed
WO-2008130894-A1 LOW TEMPERATURE CURING ACRYLATE AND MALEIMIDE BASED FORMULATIONS AND METHODS FOR USE THEREOF DESIGNER MOLECULES, INC. (US) 2008-10-30 WO disclosed