SCHEMBL29323666

SCHEMBL29323666

C=C(C)C(=O)OCCS(=O)(=O)C(C)C1CCCC1

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.40
ALDH1A1 P00352 1/20 0.40
THRB P10828 1/20 0.38
EPHX1 P07099 1/20 0.38
POLB P06746 1/20 0.30
APEX1 P27695 1/20 0.30
HTT P42858 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
SCHEMBL29323686 0.84 ALDH1A1 (0.39) TSHRALDH1A1THRB
SCHEMBL29323677 0.78 TSHR (0.50) TSHRALDH1A1THRBPOLBAPEX1
SCHEMBL29323691 0.76 THRB (0.42) TSHRALDH1A1THRBEPHX1POLB
SCHEMBL29323714 0.75 THRB (0.39) TSHRALDH1A1THRBEPHX1POLB
SCHEMBL29323669 0.75 THRB (0.41) TSHRALDH1A1THRBEPHX1POLB
SCHEMBL8407099 0.73 TSHR (0.44) TSHRALDH1A1THRBEPHX1POLB
SCHEMBL23493892 0.72 TSHR (0.56) TSHRALDH1A1THRBEPHX1
SCHEMBL23494221 0.72 THRB (0.47) TSHRALDH1A1THRBEPHX1POLB
SCHEMBL27672701 0.71 TSHR (0.55) TSHRALDH1A1THRBEPHX1
SCHEMBL9228965 0.70 THRB (0.53) TSHRALDH1A1THRBPOLBAPEX1

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