SCHEMBL9696445

SCHEMBL9696445

C=C(C)C(=O)OC(CO)(OC(=O)C(=C)C)n1c(=O)[nH]c(=O)[nH]c1=O

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 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
SCHEMBL7638251 0.85 TSHR (0.37) TSHR
SCHEMBL3949057 0.81
SCHEMBL7027995 0.77 ALDH1A1 (0.35) TSHR
SCHEMBL149918 0.74 THRB (0.36) TSHR
SCHEMBL15152 0.74 TSHR (0.33) TSHR
SCHEMBL328926 0.73 TSHR (0.32) TSHR
SCHEMBL16227843 0.73 TSHR (0.32) TSHR
Methacrylic Acid SCHEMBL10485460 0.72
SCHEMBL1284341 0.69 TYMP (0.35)
SCHEMBL153711 0.69 TSHR (0.33) TSHR

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-5127834-A ARTIFICIAL TEETH AND METHOD FOR MAKING THEM G-C TOSHI KOGYO CORPORATION (JP) 1992-07-07 US disclosed