SCHEMBL28928422

SCHEMBL28928422

CC(O)C(=O)N=CN(C)C

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.33
CYP1A2 P05177 1/20 0.30
CYP2C19 P33261 1/20 0.30
POLB P06746 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
SCHEMBL2275993 0.83 CYP1A2 (0.31) CYP1A2CYP2C19POLB
SCHEMBL12200032 0.83 CYP1A2 (0.31) CYP1A2CYP2C19POLB
SCHEMBL2275997 0.83 CYP1A2 (0.31) CYP1A2CYP2C19POLB
SCHEMBL28890358 0.83 CYP1A2 (0.31) CYP1A2CYP2C19POLB
SCHEMBL23301101 0.79
SCHEMBL21857857 0.79
SCHEMBL20899842 0.76 POLB (0.33) CYP1A2CYP2C19POLB
SCHEMBL20899843 0.76 POLB (0.33) CYP1A2CYP2C19POLB
SCHEMBL28823993 0.74 ALDH1A1 (0.34) TP53
SCHEMBL28823992 0.74 ALDH1A1 (0.34) TP53

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-115551848-A Heterocyclic compounds for controlling invertebrate pests 巴斯夫欧洲公司 2022-12-30 CN disclosed