SCHEMBL23520529

SCHEMBL23520529

C=C(C)C(=O)OC1(C(C)(C)CC)CCCCC1

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.33
ALDH1A1 P00352 2/20 0.32
ADORA3 P0DMS8 1/20 0.32
TSHR P16473 3/20 0.32

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
SCHEMBL390238 1.00 THRB (0.33) THRBALDH1A1ADORA3TSHR
SCHEMBL21173122 0.98 ALDH1A1 (0.33) THRBALDH1A1ADORA3TSHR
SCHEMBL21911838 0.87 THRB (0.33) THRBALDH1A1ADORA3TSHR
SCHEMBL354732 0.85 ALDH1A1 (0.33) THRBALDH1A1ADORA3TSHR
SCHEMBL23352251 0.85 ALDH1A1 (0.33) THRBALDH1A1ADORA3TSHR
SCHEMBL1471662 0.84 ADORA3 (0.34) ADORA3
SCHEMBL23563321 0.84 THRB (0.31) THRBALDH1A1TSHR
SCHEMBL21911839 0.83 ALDH1A1 (0.34) THRBALDH1A1TSHR
SCHEMBL263136 0.82 ALDH1A1 (0.37) ALDH1A1TSHR
SCHEMBL12521232 0.82 ALDH1A1 (0.37) ALDH1A1TSHR

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-20210181633-A1 RESIST COMPOSITION AND METHOD OF FORMING RESIST PATTERN TOKYO OHKA KOGYO CO., LTD. (JP) 2021-06-17 US disclosed