SCHEMBL10002102

SCHEMBL10002102

O=S(=O)(O)CC(F)(F)CS(=O)(=O)O

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
ALDH1A1 P00352 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
PTGS1 P23219 1/20 0.32
PDE4A P27815 1/20 0.32
LMNA P02545 1/20 0.32
SLC6A6 P31641 1/20 0.32
CYP2C19 P33261 1/20 0.32
BLM P54132 1/20 0.32
CA5A P35218 1/20 0.31
CA5B Q9Y2D0 1/20 0.31
CA1 P00915 2/20 0.30
CA2 P00918 2/20 0.30
CA7 P43166 1/20 0.30
CA13 Q8N1Q1 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
SCHEMBL19326832 0.85 ALDH1A1 (0.31) TSHRTDP1ALDH1A1L3MBTL1
SCHEMBL10101739 0.83
SCHEMBL2754981 0.83 CES1 (0.31)
SCHEMBL5500329 0.83 LMNA (0.38) TSHRTDP1LMNASLC6A6CYP2C19
SCHEMBL12159416 0.81 ATR (0.31)
SCHEMBL64334 0.80
SCHEMBL28558721 0.80 TSHR (0.35) TSHRTDP1ALDH1A1L3MBTL1PTGS1
SCHEMBL29433272 0.80 TSHR (0.35) TSHRTDP1ALDH1A1L3MBTL1PTGS1
SCHEMBL14133213 0.79
Ammonia Solution, Strong SCHEMBL2512351 0.78 ALDH1A1 (0.33) TSHRTDP1ALDH1A1L3MBTL1PTGS1

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-8147745-B2 Process for producing fiber and method for producing catalyst layer ASAHI GLASS COMPANY, LIMITED (JP) 2012-04-03 US disclosed