SCHEMBL7019166

SCHEMBL7019166

C=C(C)C(=O)C(=O)CCS(=O)(=O)O

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 1/20 0.32
PDE4A P27815 1/20 0.32
LMNA P02545 1/20 0.32
SLC6A6 P31641 1/20 0.32
CYP2C19 P33261 1/20 0.32
BLM P54132 1/20 0.32
APP P05067 1/20 0.30

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
SCHEMBL536402 0.86 PTGS1 (0.35) PTGS1PDE4ALMNASLC6A6CYP2C19
SCHEMBL9513534 0.84 PTGS1 (0.33) PTGS1PDE4ALMNASLC6A6CYP2C19
Potassium SCHEMBL9347201 0.84 PTGS1 (0.33) PTGS1PDE4ALMNASLC6A6CYP2C19
SCHEMBL13636240 0.83 PTGS1 (0.32) PTGS1PDE4ALMNASLC6A6CYP2C19
SCHEMBL8503742 0.81 KDM4E (0.34) LMNA
SCHEMBL2919345 0.77 TDP1 (0.32)
SCHEMBL25281083 0.75 ALDH1A1 (0.34)
SCHEMBL8358582 0.74 APP (0.31) APP
SCHEMBL563029 0.74 APP (0.39) PTGS1PDE4ALMNASLC6A6CYP2C19
Methacrylic Acid SCHEMBL1881169 0.74 APEX1 (0.46) PTGS1PDE4ALMNASLC6A6CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0806462-B1 CURABLE RESIN COMPOSITION FOR WATER-BASED PAINTS DAINIPPON INK & CHEMICALS (JP) 2003-01-15 EP disclosed
US-6333368-B1 CURABLE RESIN FOR WATER BASED PAINTS WITH DISPERSION OR DISSOLVING WATER IN VINYL POLYMER WITH TERT AMINO AND ACID FUNCTIONS, COMPOUND B WITH EPOXY AND HYDROLYZABLE SILYL GROUPS DAINIPPON INK & CHEMICALS, INC. (JP) 2001-12-25 US disclosed
US-6103788-A RESIN COMPOSITION CONSISTING OF EMULSION POLYMER CONTAINING TERTIARY AMINO GROUPS, COMPOUND CONTAINING EPOXY GROUP AND HYDROLYZABLE SILYL GROUP DAINIPPON INK AND CHEMICALS, INC. (JP) 2000-08-15 US disclosed
EP-0806462-A1 CURABLE RESIN COMPOSITION FOR WATER-BASED PAINTS DAINIPPON INK AND CHEMICALS, INC. (JP) 1997-11-12 EP disclosed