SCHEMBL9608604

SCHEMBL9608604

CCS(=O)(=O)N(C)S(=O)(=O)CCS(=O)(=O)O

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 1/20 0.35
PDE4A P27815 1/20 0.35
LMNA P02545 1/20 0.35
SLC6A6 P31641 1/20 0.35
CYP2C19 P33261 1/20 0.35
BLM P54132 1/20 0.35
APP P05067 1/20 0.32

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
SCHEMBL12725413 0.79 CA1 (0.33)
SCHEMBL4400378 0.79 CA1 (0.40)
SCHEMBL15368928 0.76 CA1 (0.35)
SCHEMBL9608596 0.75 LMNA (0.38) PTGS1PDE4ALMNASLC6A6CYP2C19
Trimethylammonium SCHEMBL6398997 0.74 PTGS1 (0.41) PTGS1PDE4ALMNASLC6A6CYP2C19
SCHEMBL28699708 0.73 PTGS1 (0.36) PTGS1PDE4ALMNASLC6A6CYP2C19
SCHEMBL1065719 0.73 PTGS1 (0.50) PTGS1PDE4ALMNASLC6A6CYP2C19
Sulfuric Acid SCHEMBL21631138 0.72 PTGS1 (0.39) PTGS1PDE4ALMNASLC6A6CYP2C19
Sulfuric Acid SCHEMBL28349750 0.72 PTGS1 (0.39) PTGS1PDE4ALMNASLC6A6CYP2C19
SCHEMBL15368918 0.72 ALDH1A1 (0.42) LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120135348-A1 ACTINIC-RAY-SENSITIVE OR RADIATION-SENSITIVE RESIN COMPOSITION, ACTINIC-RAY-SENSITIVE OR RADIATION-SENSITIVE FILM, AND PATTERN FORMING METHOD FUJIFILM CORPORATION (JP) 2012-05-31 US disclosed