SCHEMBL11458063

SCHEMBL11458063

CCCCCCCCCCCCCCCCCCS(=O)(=O)CCO

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.56
CES1 P23141 5/20 0.50
FAAH O00519 5/20 0.50
CES2 O00748 2/20 0.50
LMNA P02545 2/20 0.48
ALDH1A1 P00352 1/20 0.48
HSD17B10 Q99714 1/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
TSHR P16473 1/20 0.48
ESR1 P03372 1/20 0.44
ESR2 Q92731 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL11089298 1.00 CA2 (0.56) CA2CES1FAAHCES2LMNA
SCHEMBL11448013 1.00 CA2 (0.56) CA2CES1FAAHCES2LMNA
SCHEMBL27800893 1.00 CA2 (0.56) CA2CES1FAAHCES2LMNA
SCHEMBL11457709 1.00 CA2 (0.56) CA2CES1FAAHCES2LMNA
SCHEMBL11466485 1.00 CA2 (0.56) CA2CES1FAAHCES2LMNA
SCHEMBL11447827 1.00 CA2 (0.56) CA2CES1FAAHCES2LMNA
SCHEMBL14814387 1.00 CA2 (0.56) CA2CES1FAAHCES2LMNA
SCHEMBL5669005 0.98 CA2 (0.52) CA2CES1FAAHCES2LMNA
Ammonia Solution, Strong SCHEMBL9242895 0.95 CA2 (0.50) CA2CES1FAAHCES2LMNA
Propanol SCHEMBL8778799 0.93 CA2 (0.58) CA2CES1FAAHCES2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4225449-A HYDROCARBYLSULFONYL OR SULFINYL ALKANOL EDWIN COOPER, INC. (US) 1980-09-30 US claimed
WO-2011073473-A1 VINYL SULPHONE FUNCTIONALISED LIPID SYSTEMS. SYNTHESIS AND USES UNIVERSIDAD DE GRANADA (ES) 2011-06-23 WO disclosed
CN-1780937-A Enhancing silver tarnish-resistance MIDDLESEX SILVER CO LTD (GB) 2006-05-31 CN disclosed
US-4225449-A HYDROCARBYLSULFONYL OR SULFINYL ALKANOL EDWIN COOPER, INC. (US) 1980-09-30 US disclosed