SCHEMBL9400739

SCHEMBL9400739

O=C(OS)c1cc(C(=O)OS)c(C(=O)OS)cc1C(=O)OS

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 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
SCHEMBL27449625 0.77 TSHR (0.50) —
SCHEMBL11331912 0.71 CES2 (0.35) —
SCHEMBL829753 0.69 CA12 (0.54) —
SCHEMBL27263971 0.69 CA1 (0.44) —
SCHEMBL7371804 0.68 NPC1 (0.50) HTT
SCHEMBL28993877 0.68 ALDH1A1 (0.64) —
SCHEMBL18648419 0.66 KDM4E (0.61) —
SCHEMBL3775895 0.65 ALDH1A1 (0.47) HTT
SCHEMBL887647 0.65 ALDH1A1 (0.39) —
SCHEMBL7527292 0.63 CA12 (0.59) HTT

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
US-5310826-A Thiolic compound polymerization cocatalysts AKZO N.V. (NL) 1994-05-10 — — US disclosed
EP-0470139-A1 THIOLIC COMPOUND POLYMERIZATION COCATALYSTS. AKZO NV (NL) 1992-02-12 — — EP disclosed
WO-1990012826-A1 THIOLIC COMPOUND POLYMERIZATION COCATALYSTS AKZO N.V. (NL) 1990-11-01 — — WO disclosed
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