SCHEMBL28984923

SCHEMBL28984923

Cc1ccc(N2CCC(NC(=O)C(=O)c3c[nH]c4ccc(F)cc34)C2=O)c(Cl)c1

nearest known ligand 0.78

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
B3GAT3 O94766 1/20 0.78
CDK4 P11802 3/20 0.44
CCND1 P24385 3/20 0.44
ALDH1A1 P00352 4/20 0.41
KMT2A Q03164 1/20 0.41
ROCK2 O75116 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.39
HSD11B1 P28845 1/20 0.39
HPGD P15428 1/20 0.38
F10 P00742 1/20 0.38

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
SCHEMBL29504687 0.91 B3GAT3 (0.79) B3GAT3CDK4CCND1SMN1; SMN2
SCHEMBL29504741 0.91 B3GAT3 (0.79) B3GAT3CDK4CCND1
SCHEMBL28984921 0.91 B3GAT3 (0.79) B3GAT3CDK4CCND1SMN1; SMN2
SCHEMBL28984931 0.91 B3GAT3 (0.79) B3GAT3CDK4CCND1
SCHEMBL29504713 0.91 B3GAT3 (0.79) B3GAT3CDK4CCND1
SCHEMBL28984922 0.89 B3GAT3 (0.85) B3GAT3CDK4CCND1
SCHEMBL29504777 0.89 B3GAT3 (0.76) B3GAT3CDK4CCND1KMT2A
SCHEMBL29504658 0.88 B3GAT3 (0.81) B3GAT3ALDH1A1KMT2AROCK2SMN1; SMN2
SCHEMBL30267518 0.88 B3GAT3 (1.00) B3GAT3CDK4CCND1ROCK2
SCHEMBL28984919 0.88 B3GAT3 (0.75) B3GAT3CDK4CCND1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115974849-A Indoxyl acetamide derivative, pharmaceutical composition containing indoxyl acetamide derivative and application of indoxyl acetamide derivative 中国药科大学 2023-04-18 CN claimed
CN-115974849-B Indolyloxy acetamide derivative, pharmaceutical composition containing same and application of pharmaceutical composition 中国药科大学 2024-06-21 CN disclosed
CN-115974849-A Indoxyl acetamide derivative, pharmaceutical composition containing indoxyl acetamide derivative and application of indoxyl acetamide derivative 中国药科大学 2023-04-18 CN disclosed