SCHEMBL8565011

SCHEMBL8565011

C=C(C)C(=O)OC(C)NS(=O)(=O)CCCCCCCC

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.44
PLA2G2C Q5R387 1/20 0.36
LMNA P02545 2/20 0.35
FAAH O00519 3/20 0.35
CES2 O00748 2/20 0.35
CES1 P23141 1/20 0.35

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
SCHEMBL9436878 0.87 TSHR (0.33) TSHR
SCHEMBL8560751 0.80 TSHR (0.39) TSHRLMNAFAAHCES2
SCHEMBL9436876 0.79 TSHR (0.40) TSHRPLA2G2CLMNAFAAH
SCHEMBL29044528 0.76 TSHR (0.49) TSHRLMNAFAAH
SCHEMBL5872131 0.76 TSHR (0.45) TSHRLMNAFAAHCES1
SCHEMBL10610014 0.76 TSHR (0.49) TSHRLMNAFAAH
SCHEMBL9279513 0.76 TSHR (0.49) TSHRLMNAFAAH
SCHEMBL8052192 0.76 TSHR (0.49) TSHRLMNAFAAH
Iodide SCHEMBL28815267 0.75 TSHR (0.47) TSHRLMNAFAAH
Hydrochloric Acid SCHEMBL725775 0.75 TSHR (0.47) TSHRLMNAFAAH

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-5725789-A FOR FABRICS; POLYALKOXYLATED POLYURETHANE, FLUOROCHEMICAL ACRYLATE POLYMER MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1998-03-10 US claimed
WO-1996030584-A1 AQUEOUS OIL AND WATER REPELLENT COMPOSITIONS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1996-10-03 WO claimed