SCHEMBL29323686

SCHEMBL29323686

C=C(C)C(=O)OCCS(=O)(=O)C(C)C1CCOC1

nearest known ligand 0.39

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.39
TSHR P16473 3/20 0.36
THRB P10828 1/20 0.35

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
SCHEMBL29323666 0.84 TSHR (0.40) ALDH1A1TSHRTHRB
SCHEMBL29323677 0.74 TSHR (0.50) ALDH1A1TSHRTHRB
SCHEMBL14607412 0.72 ALDH1A1 (0.39) ALDH1A1TSHRTHRB
SCHEMBL29323688 0.72 ALDH1A1 (0.39) ALDH1A1TSHRTHRB
Oxirane SCHEMBL3776781 0.68 THRB (0.61) ALDH1A1TSHRTHRB
SCHEMBL14607538 0.68 TSHR (0.41) ALDH1A1TSHRTHRB
SCHEMBL3238105 0.67 ALDH1A1 (0.57) ALDH1A1TSHRTHRB
SCHEMBL9228965 0.67 THRB (0.53) ALDH1A1TSHRTHRB
Dioxane SCHEMBL3323024 0.67 THRB (0.59) ALDH1A1TSHRTHRB
SCHEMBL29323691 0.66 THRB (0.42) ALDH1A1TSHRTHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240241440-A1 POLYMER, PHOTORESIST COMPOSITIONS INCLUDING THE SAME, AND PATTERN FORMATION METHODS U.S. BANK TRUST COMPANY, NATIONAL ASSOCIATION, AS NOTES COLLATERAL AGENT 2024-07-18 US disclosed
US-20240241440-A1 POLYMER, PHOTORESIST COMPOSITIONS INCLUDING THE SAME, AND PATTERN FORMATION METHODS U.S. BANK TRUST COMPANY, NATIONAL ASSOCIATION, AS NOTES COLLATERAL AGENT 2024-07-18 US disclosed