SCHEMBL28137402

SCHEMBL28137402

CCC1(NC(C)=O)C=CC=CC1

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 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
SCHEMBL28785386 0.84
SCHEMBL27796278 0.84
SCHEMBL29145663 0.83
SCHEMBL29145669 0.83
SCHEMBL29145667 0.83
SCHEMBL28167857 0.82
SCHEMBL28171332 0.81 HDAC3 (0.34)
SCHEMBL10392267 0.80 ALDH1A1 (0.33) ALDH1A1
SCHEMBL28136472 0.80 ZDHHC20 (0.30)
SCHEMBL28352059 0.77

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116855468-A R-aminotransferase from mycobacterium and synthesis method thereof 江苏海洋大学 2023-10-10 CN disclosed
CN-112824421-A Chiral phosphine-phosphoramidite ligand and preparation method and application thereof 中国科学院大连化学物理研究所 2021-05-21 CN disclosed
CN-106565517-B A method of amide is prepared by arylmethane derivative and nitrile 湖南大学 2018-08-17 CN disclosed
CN-106565517-A Method for preparing amide from aryl methane derivative and nitrile 湖南大学 2017-04-19 CN disclosed