SCHEMBL14543776

SCHEMBL14543776

C=C(C)C(=O)OC(C)CC(C)(C)CC(C)C

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.44
ALDH1A1 P00352 1/20 0.34
THRB P10828 1/20 0.31
MMP8 P22894 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
SCHEMBL23493816 0.86 TSHR (0.40) TSHRALDH1A1THRB
SCHEMBL23494139 0.83 TSHR (0.44) TSHRALDH1A1THRB
SCHEMBL4654910 0.81 TSHR (0.42) TSHRALDH1A1THRB
SCHEMBL8616060 0.80 TSHR (0.41) TSHRALDH1A1THRB
SCHEMBL2022221 0.80 TSHR (0.41) TSHRALDH1A1THRB
SCHEMBL18121617 0.80 TSHR (0.41) TSHRALDH1A1THRB
Hydrochloric Acid SCHEMBL9145394 0.79 TSHR (0.40) TSHRALDH1A1THRB
SCHEMBL1559806 0.79 TSHR (0.40) TSHRALDH1A1THRB
SCHEMBL25561465 0.79 TSHR (0.40) TSHRALDH1A1THRB
SCHEMBL6849319 0.78 TSHR (0.42) TSHRALDH1A1THRB

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-7205090-B2 Chemical amplification type positive resist composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-04-17 US disclosed