SCHEMBL4857770

SCHEMBL4857770

O=S(=O)(O)C(CCCl)S(=O)(=O)O.O=S(=O)(O)CCS(=O)(=O)O

nearest known ligand 0.40

Known targets — ChEMBL curated mechanism

DRD2

The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 8)

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
SLC22A6 Q4U2R8 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
SCHEMBL2257854 0.90
SCHEMBL8346373 0.79 PTGS1 (0.41) PTGS1PDE4ALMNASLC6A6CYP2C19
SCHEMBL2775253 0.76
SCHEMBL27714617 0.75 CA1 (0.31)
SCHEMBL27694688 0.73 CA1 (0.30)
SCHEMBL330743 0.70
SCHEMBL2622 0.69 PTGS1 (0.60) PTGS1PDE4ALMNASLC6A6CYP2C19
SCHEMBL21777928 0.69 PTGS1 (0.60) PTGS1PDE4ALMNASLC6A6CYP2C19
SCHEMBL2400458 0.68
SCHEMBL11702623 0.68

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
US-7452486-B2 Zinc lanthanide sulfonic acid electrolytes ARKEMA INC. (US) 2008-11-18 US disclosed
US-20070051925-A1 Zinc lanthanide sulfonic acid electrolytes ARKEMA INC. 2007-03-08 US disclosed