SCHEMBL30715243

SCHEMBL30715243

c1ccc(-c2cccc3c2[nH]c2cccc(-c4ccccc4)c23)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK4 P11802 9/20 0.65
CCND1 P24385 9/20 0.65
CCNB2 O95067 1/20 0.60
CCNE2 O96020 1/20 0.60
CDK1 P06493 1/20 0.60
CCNB1 P14635 1/20 0.60
CCNE1 P24864 1/20 0.60
CDK2 P24941 1/20 0.60
CCNB3 Q8WWL7 1/20 0.60
FEN1 P39748 1/20 0.47
LIMK1 P53667 2/20 0.47
CLK4 Q9HAZ1 2/20 0.47
PLK4 O00444 1/20 0.47
MAPK9 P45984 1/20 0.47
AKT3 Q9Y243 1/20 0.47
MAP4K4 O95819 1/20 0.46
CSF1R P07333 1/20 0.46
FGFR1 P11362 1/20 0.46
PDGFRA P16234 1/20 0.46
LTK P29376 1/20 0.46

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
SCHEMBL29143350 1.00 CDK4 (0.65) CDK4CCND1CCNB2CCNE2CDK1
SCHEMBL25721346 0.92 CDK4 (0.57) CDK4CCND1CCNB2CCNE2CDK1
SCHEMBL27780959 0.86 CDK4 (0.76) CDK4CCND1CCNB2CCNE2CDK1
SCHEMBL26203473 0.86 DYRK1A (0.62) CDK4CCND1CCNB2CCNE2CDK1
SCHEMBL24037176 0.85 CDK4 (0.58) CDK4CCND1CCNB2CCNE2CDK1
SCHEMBL191031 0.85 CDK4 (0.55) CDK4CCND1CCNB2CCNE2CDK1
SCHEMBL29412285 0.85 CDK4 (0.55) CDK4CCND1CCNB2CCNE2CDK1
SCHEMBL1177888 0.85 IMPDH2 (0.55) CDK4CCND1CCNB2CCNE2CDK1
SCHEMBL31664385 0.85 IMPDH2 (0.55) CDK4CCND1CCNB2CCNE2CDK1
SCHEMBL31235721 0.83 CDK4 (0.54) CDK4CCND1CCNB2CCNE2CDK1

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-117402102-A Diamine containing carbazole moieties and polyimide gas separation membrane prepared from diamine and method 西北工业大学 2024-01-16 CN claimed
CN-117487688-A Bacillus cereus and application thereof in heavy metal pollution treatment 广东工业大学 2024-02-02 CN disclosed
CN-117402102-A Diamine containing carbazole moieties and polyimide gas separation membrane prepared from diamine and method 西北工业大学 2024-01-16 CN disclosed