SCHEMBL28375604

SCHEMBL28375604

CCN(CC)C(=O)C=Cc1cccs1

nearest known ligand 0.61

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.61
MAPK1 P28482 1/20 0.61
HCAR2 Q8TDS4 1/20 0.57
NPC1 O15118 1/20 0.57
L3MBTL1 Q9Y468 1/20 0.57
ALDH1A1 P00352 1/20 0.56
THRB P10828 1/20 0.56
TRPM8 Q7Z2W7 1/20 0.54
MAPT P10636 1/20 0.54
HTT P42858 1/20 0.54
KMT2A Q03164 1/20 0.54
TAS1R3 Q7RTX0 1/20 0.52
TAS1R1 Q7RTX1 1/20 0.52
HPGD P15428 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
CYP1A2 P05177 1/20 0.51
ABCG2 Q9UNQ0 1/20 0.49

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
SCHEMBL30266517 1.00 LMNA (0.61) LMNAMAPK1HCAR2NPC1L3MBTL1
SCHEMBL2719532 0.89 TRPM8 (0.71) LMNAMAPK1HCAR2ALDH1A1THRB
SCHEMBL2719528 0.89 TRPM8 (0.71) LMNAMAPK1HCAR2ALDH1A1THRB
SCHEMBL28376870 0.85 MAPT (0.59) LMNAMAPK1HCAR2ALDH1A1THRB
SCHEMBL3164680 0.81 HCAR2 (0.62) LMNAHCAR2NPC1ALDH1A1MAPT
SCHEMBL6937661 0.81 SMN1; SMN2 (0.58) LMNAHCAR2ALDH1A1MAPTHTT
SCHEMBL6937665 0.81 SMN1; SMN2 (0.58) LMNAHCAR2ALDH1A1MAPTHTT
SCHEMBL18983992 0.79 HCAR2 (0.59) LMNAMAPK1HCAR2NPC1ALDH1A1
SCHEMBL9520111 0.78 HCAR2 (0.62) LMNAHCAR2NPC1ALDH1A1MAPT
SCHEMBL9520106 0.78 HCAR2 (0.62) LMNAHCAR2NPC1ALDH1A1MAPT

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-111072597-B Piperine derivative and preparation method and application thereof 四川大学 2022-12-09 CN disclosed
CN-111018735-B Preparation method of cinnamamide compound 河南农业大学 2021-09-07 CN disclosed
CN-111072597-A Piperine derivative and preparation method and application thereof 四川大学 2020-04-28 CN disclosed
CN-111018735-A Preparation method of cinnamamide 河南农业大学 2020-04-17 CN disclosed