SCHEMBL28734571

SCHEMBL28734571

COC(COC(=O)C(C)C(=O)OCC(OC)OC)OC

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.32
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL1929980 0.85 ELANE (0.33) TSHRSMN1; SMN2
SCHEMBL23817370 0.83 TP53 (0.33) TSHRSMN1; SMN2
SCHEMBL2349139 0.79 ALDH1A1 (0.41) TSHRSMN1; SMN2
SCHEMBL783998 0.78
SCHEMBL27468197 0.77 SLC1A3 (0.31)
SCHEMBL784658 0.77 TDP1 (0.45) TSHRSMN1; SMN2
SCHEMBL2275427 0.76 TSHR (0.52) TSHRSMN1; SMN2
SCHEMBL7603527 0.75 ALOX15 (0.46) TSHRSMN1; SMN2
SCHEMBL11720069 0.75 TSHR (0.43) TSHR
SCHEMBL6486446 0.75 ALDH1A1 (0.31)

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
CN-114341215-A Curable composition 株式会社日本触媒 2022-04-12 CN disclosed