SCHEMBL1067729

SCHEMBL1067729

NCCS(=O)(=O)OS(=O)(=O)CCNCl

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.32
SLC6A6 P31641 1/20 0.32
CYP2C19 P33261 1/20 0.32
BLM P54132 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
SCHEMBL714443 0.81 LMNA (0.45) LMNASLC6A6CYP2C19BLM
SCHEMBL28271385 0.78 LMNA (0.32) LMNASLC6A6CYP2C19BLM
SCHEMBL27495299 0.78 LMNA (0.43) LMNASLC6A6CYP2C19BLM
SCHEMBL27495687 0.77 LMNA (0.31) LMNASLC6A6CYP2C19BLM
Taurine SCHEMBL1067725 0.71 LMNA (0.64) LMNASLC6A6CYP2C19BLM
SCHEMBL11570746 0.71 RELA (0.44) CYP2C19
SCHEMBL3379127 0.70
SCHEMBL5604302 0.70
SCHEMBL5070482 0.70 LMNA (0.32) LMNASLC6A6CYP2C19BLM
SCHEMBL628770 0.69 LMNA (0.39) LMNASLC6A6CYP2C19BLM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2271331-A1 COMPOSITIONS AND DEVICES FOR ANTISEPSIS AND ANTICOAGULATION Gottardi, Waldemar (AT) 2011-01-12 EP disclosed
WO-2009127924-A1 COMPOSITIONS AND DEVICES FOR ANTISEPSIS AND ANTICOAGULATION GOTTARDI WALDEMAR (AT) 2009-10-22 WO disclosed