SCHEMBL30940609

SCHEMBL30940609

CC(C)NP(=O)(NOCCC#N)NC(C)C

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
BCHE P06276 1/20 0.33
HIF1A Q16665 1/20 0.33

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
SCHEMBL20581719 0.71
SCHEMBL2180333 0.71
SCHEMBL18533401 0.70
SCHEMBL11023549 0.63 ALDH1A1 (0.53) ALDH1A1BCHEHIF1A
SCHEMBL12707039 0.62 TSHR (0.32)
SCHEMBL14189792 0.60 CTSA (0.33)
Acetonitrile SCHEMBL3841070 0.60
SCHEMBL3501857 0.59 TSHR (0.30)
SCHEMBL18048378 0.59 TSHR (0.30)
SCHEMBL413500 0.59

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-118369427-A Extrahepatic delivery IRNA compositions and methods of use thereof 阿尔尼拉姆医药品有限公司 2024-07-19 CN disclosed