SCHEMBL29137396

SCHEMBL29137396

C=C(C)C(=O)OC(C)C(C)C(N)CCS(=O)(=O)O

nearest known ligand 0.35

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ENPEP Q07075 16/20 0.35
TSHR P16473 1/20 0.34

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
SCHEMBL29063501 0.78 TSHR (0.40) TSHR
SCHEMBL8368275 0.77 TSHR (0.37) ENPEPTSHR
SCHEMBL8966142 0.73 TSHR (0.46) TSHR
SCHEMBL27826917 0.72 TSHR (0.38) TSHR
SCHEMBL3738602 0.72 TSHR (0.32) TSHR
SCHEMBL27681349 0.71 TSHR (0.37) TSHR
Ammonia Solution, Strong SCHEMBL27806401 0.71 TSHR (0.37) TSHR
Ammonia Solution, Strong SCHEMBL5888600 0.71 TSHR (0.34) TSHR
Sulfuric Acid SCHEMBL9219819 0.70 TSHR (0.41) TSHR
SCHEMBL7155795 0.70 TSHR (0.36) 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-117126344-A Amphoteric hyperbranched polycarboxylic acid dispersing agent, preparation method thereof and application thereof in low-rank coal water slurry 陕西科技大学 2023-11-28 CN claimed
CN-117126344-A Amphoteric hyperbranched polycarboxylic acid dispersing agent, preparation method thereof and application thereof in low-rank coal water slurry 陕西科技大学 2023-11-28 CN disclosed