SCHEMBL11798345

SCHEMBL11798345

O=S(=O)([O-])F.O=S(=O)([O-])F.O=S(=O)([O-])F.[Fe+3]

nearest known ligand 0.42

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.42
TDP1 Q9NUW8 1/20 0.42
MEN1 O00255 1/20 0.39
ALDH1A1 P00352 1/20 0.39
KMT2A Q03164 1/20 0.39

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
Fluoride Ion SCHEMBL11588881 0.95
Lithium Ion SCHEMBL2582953 0.95 TSHR (0.39) TSHRTDP1MEN1ALDH1A1KMT2A
SCHEMBL8053302 0.89
SCHEMBL8379763 0.89 TSHR (0.42) TSHRTDP1MEN1ALDH1A1KMT2A
Lithium Ion SCHEMBL15474529 0.89 TSHR (0.42) TSHRTDP1MEN1ALDH1A1KMT2A
SCHEMBL9192591 0.89 TSHR (0.42) TSHRTDP1MEN1ALDH1A1KMT2A
SCHEMBL22409127 0.89 TSHR (0.42) TSHRTDP1MEN1ALDH1A1KMT2A
Lithium Ion SCHEMBL349010 0.89
SCHEMBL1415126 0.89
SCHEMBL8378121 0.89 TSHR (0.42) TSHRTDP1MEN1ALDH1A1KMT2A

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-3991108-A PRODUCTION OF ACYL AND CARBAMOYL FLUORIDES AND THEIR CORRESPONDING ISOCYANATES JORDAN ROBERT KENNETH 1976-11-09 US disclosed