SCHEMBL28590397

SCHEMBL28590397

CC(C)(O)NC(C)(C)O.[Zn]

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.31
THRB P10828 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
SCHEMBL23224 0.95
Ammonia Solution, Strong SCHEMBL28181730 0.91 ALDH1A1 (0.31) ALDH1A1THRB
SCHEMBL839562 0.91 ALDH1A1 (0.31) ALDH1A1THRB
Fluoride SCHEMBL6858466 0.91 ALDH1A1 (0.31) ALDH1A1THRB
Hydrochloric Acid SCHEMBL3362611 0.91 ALDH1A1 (0.31) ALDH1A1THRB
Potassium Ion SCHEMBL28262307 0.87
Ethylene Glycol SCHEMBL27570413 0.81 TSHR (0.36) ALDH1A1
Ethylene Glycol SCHEMBL28166722 0.81 TSHR (0.36) ALDH1A1
SCHEMBL4238474 0.78
Sulfuric Acid SCHEMBL28651693 0.78 CA5A (0.40) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113068713-A Efficient algae remover and application thereof 江苏曌之源实业有限公司 2021-07-06 CN disclosed