SCHEMBL28911571

SCHEMBL28911571

C#CC(C)NCC(=O)CC(C)O

nearest known ligand 0.37

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ACHE P22303 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
SCHEMBL20377961 0.75
SCHEMBL600244 0.75
SCHEMBL20377969 0.75
SCHEMBL28911533 0.74 MAOA (0.33)
SCHEMBL28911619 0.70 ADRB2 (0.35)
SCHEMBL2775806 0.68 CYP2C19 (0.44) ACHE
SCHEMBL26597900 0.65 ADH1B (0.39)
SCHEMBL22131266 0.64
SCHEMBL7781837 0.63 LDHA (0.40)
SCHEMBL1259907 0.63 LDHA (0.40)

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-115466287-A Halophosphite and preparation method and application thereof 恒大新能源技术(深圳)有限公司 2022-12-13 CN disclosed
CN-115448945-A Halogenated phosphate and preparation method and application thereof 恒大新能源技术(深圳)有限公司 2022-12-09 CN disclosed