Vinyl Chloride

Vinyl Chloride

SCHEMBL7074129

C=CCl.O=S(=O)(O)CCN1CCN(CCS(=O)(=O)O)CC1

nearest known ligand 0.57

Full drug profile on Sugi Atlas →

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HTR4 Q13639 1/20 0.32
PTGS1 P23219 1/20 0.31
PDE4A P27815 1/20 0.31
LMNA P02545 1/20 0.31
SLC6A6 P31641 1/20 0.31
CYP2C19 P33261 1/20 0.31
BLM P54132 1/20 0.31

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
SCHEMBL14414885 0.87 PTGS1 (0.39) HTR4PTGS1PDE4ALMNASLC6A6
SCHEMBL63679 0.87 PTGS1 (0.39) HTR4PTGS1PDE4ALMNASLC6A6
SCHEMBL789961 0.87 PTGS1 (0.39) HTR4PTGS1PDE4ALMNASLC6A6
SCHEMBL2403909 0.87
SCHEMBL25336178 0.84 PTGS1 (0.38) HTR4PTGS1PDE4ALMNASLC6A6
SCHEMBL8463674 0.84 PTGS1 (0.38) HTR4PTGS1PDE4ALMNASLC6A6
SCHEMBL11343102 0.84 PTGS1 (0.38) HTR4PTGS1PDE4ALMNASLC6A6
Ammonia Solution, Strong SCHEMBL9351921 0.84 PTGS1 (0.38) HTR4PTGS1PDE4ALMNASLC6A6
SCHEMBL9897194 0.84 PTGS1 (0.38) HTR4PTGS1PDE4ALMNASLC6A6
Water SCHEMBL15641760 0.82 PTGS1 (0.36) HTR4PTGS1PDE4ALMNASLC6A6

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-20040255974-A1 Equipment cleaner BURRANT CHEMICAL, L.L.C. 2004-12-23 US disclosed