SCHEMBL9855752

SCHEMBL9855752

O=S(=O)(O)C(F)(F)C(F)(F)S(=O)(=O)Cl.[KH]

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
TSHR P16473 1/20 0.30
TDP1 Q9NUW8 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
SCHEMBL2501689 0.85 ALDH1A1 (0.45) ALDH1A1L3MBTL1TSHRTDP1
SCHEMBL9856221 0.84 ALDH1A1 (0.33) ALDH1A1L3MBTL1
SCHEMBL9856037 0.84 CA2 (0.33) ALDH1A1L3MBTL1
SCHEMBL7737443 0.82 CA1 (0.35)
SCHEMBL301944 0.82 ALDH1A1 (0.47) ALDH1A1L3MBTL1TSHRTDP1
SCHEMBL9855949 0.79 ALDH1A1 (0.33) ALDH1A1L3MBTL1
SCHEMBL2501489 0.78 ALDH1A1 (0.45) ALDH1A1L3MBTL1TSHRTDP1
SCHEMBL13571628 0.78 ALDH1A1 (0.45) ALDH1A1L3MBTL1TSHRTDP1
SCHEMBL5014775 0.78 ALDH1A1 (0.45) ALDH1A1L3MBTL1TSHRTDP1
SCHEMBL9856311 0.74 TSHR (0.39) ALDH1A1L3MBTL1TSHRTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0280392-B1 PREPARATION AND REACTIONS OF OMEGA-HALOSULFONYL PERFLUOROALKANESULFONATES MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1991-08-28 EP disclosed
US-5011983-A Chemical intermediates, latent catalysts MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1991-04-30 US disclosed
EP-0280392-A1 Preparation and reactions of omega-halosulfonyl perfluoroalkanesulfonates MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1988-08-31 EP disclosed