SCHEMBL3259780

SCHEMBL3259780

C=CCC1(OC(=O)COC(=O)C(=C)C)C2CC3CC(C2)CC1C3

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
TSHR P16473 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
SCHEMBL685781 0.87 ALDH1A1 (0.36) ALDH1A1TSHR
SCHEMBL1079039 0.86 ALDH1A1 (0.32) ALDH1A1
SCHEMBL950137 0.84 ALDH1A1 (0.35) ALDH1A1TSHR
SCHEMBL685775 0.83 TSHR (0.35) ALDH1A1TSHR
SCHEMBL3257832 0.83 ALDH1A1 (0.32) ALDH1A1TSHR
SCHEMBL214191 0.82 CYP17A1 (0.42) ALDH1A1TSHR
SCHEMBL685555 0.82 TSHR (0.40) ALDH1A1TSHR
SCHEMBL684928 0.81 TSHR (0.39) ALDH1A1TSHR
SCHEMBL212781 0.80 CYP17A1 (0.41) ALDH1A1TSHR
SCHEMBL950611 0.79 MAPT (0.33) ALDH1A1

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-8232039-B2 Polymer and resist composition comprising the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-07-31 US disclosed
US-20100124719-A1 Polymer and Resist Composition Comprising the Same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-05-20 US disclosed