SCHEMBL11849643

SCHEMBL11849643

O=C(C(O)C(O)C(=O)S(=O)(=O)O)S(=O)(=O)O

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.35
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 1/20 0.35
KMT2A Q03164 1/20 0.35
CA5A P35218 1/20 0.33
CA5B Q9Y2D0 1/20 0.33

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
SCHEMBL10477524 0.87 TSHR (0.32) TSHRMEN1ALDH1A1KMT2A
SCHEMBL980780 0.84 LMNA (0.31) TSHRMEN1ALDH1A1KMT2A
SCHEMBL28987639 0.78 PDE4A (0.44) TSHRALDH1A1
SCHEMBL30839620 0.78 PDE4A (0.44) TSHRALDH1A1
SCHEMBL30839622 0.78 PDE4A (0.44) TSHRALDH1A1
SCHEMBL29386396 0.76
SCHEMBL30469495 0.74 LMNA (0.48)
SCHEMBL2363381 0.73
SCHEMBL9632218 0.69 OR51E2 (0.46)
SCHEMBL28776105 0.69

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-3994972-A Synthesis of N,N',N\",N'\"-tetra-salicylidene pentaerythrityl tetramine HORIZONS INCORPORATED, A DIVISION OF HORIZONS RESEARCH INCORPORATED (US) 1976-11-30 US claimed