SCHEMBL29019014

SCHEMBL29019014

C=C(C)C(=O)OC.C=C(C)C(=O)OC(F)(F)C(F)CC(F)(F)F

nearest known ligand 0.47

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.47
TSHR P16473 1/20 0.36
MAPT P10636 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
SCHEMBL216127 0.94 TSHR (0.36) ALDH1A1TSHR
Alcohol SCHEMBL28215508 0.89 TSHR (0.33) ALDH1A1TSHR
Methacrylic Acid SCHEMBL28063227 0.89 TSHR (0.33) ALDH1A1TSHR
Acrylic Acid SCHEMBL28280460 0.85 TSHR (0.31) TSHR
Styrene SCHEMBL29019021 0.84 ALDH1A1 (0.33) ALDH1A1TSHRMAPT
SCHEMBL27974446 0.84 ALDH1A1 (0.56) ALDH1A1TSHR
SCHEMBL28116628 0.84 TSHR (0.30) TSHR
SCHEMBL31155812 0.84 TSHR (0.30) TSHR
SCHEMBL9317634 0.82 ALDH1A1 (0.38) ALDH1A1TSHR
SCHEMBL28678100 0.81 HTT (0.37) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116285407-A High-fluidity tea residue/polypropylene composite material and preparation method thereof 韩山师范学院 2023-06-23 CN claimed
CN-116285407-A High-fluidity tea residue/polypropylene composite material and preparation method thereof 韩山师范学院 2023-06-23 CN disclosed