SCHEMBL30582967

SCHEMBL30582967

NNc1nccc(-c2ccccc2)c1-c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 2/20 0.42
PRKACA P17612 2/20 0.42
IKBKB O14920 1/20 0.42
CHUK O15111 1/20 0.42
DAPK3 O43293 1/20 0.42
JAK2 O60674 1/20 0.42
PRKD3 O94806 1/20 0.42
MAP4K4 O95819 1/20 0.42
PAK4 O96013 1/20 0.42
CSF1R P07333 1/20 0.42
RET P07949 1/20 0.42
IGF1R P08069 1/20 0.42
FGFR1 P11362 1/20 0.42
FLT1 P17948 1/20 0.42
LTK P29376 1/20 0.42
GRK5 P34947 1/20 0.42
KDR P35968 1/20 0.42
MAP2K2 P36507 1/20 0.42
MAPK8 P45983 1/20 0.42
CSNK1A1 P48729 1/20 0.42

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
SCHEMBL9838637 1.00 LRRK2 (0.42) LRRK2PRKACAIKBKBCHUKDAPK3
SCHEMBL10348175 0.80 LRRK2 (0.41) LRRK2PRKACAIKBKBCHUKDAPK3
SCHEMBL4469263 0.77 SMN1; SMN2 (0.45) LRRK2KDRMAPTALDH1A1TDP1
SCHEMBL29360194 0.75 GSK3B (0.46) LRRK2PRKACAIKBKBCHUKDAPK3
SCHEMBL4647645 0.75 GSK3B (0.46) LRRK2PRKACAIKBKBCHUKDAPK3
SCHEMBL996432 0.72 CCNA2 (0.45) LRRK2PRKACAIKBKBCHUKDAPK3
SCHEMBL2489243 0.72 LRRK2 (0.43) LRRK2PRKACAIKBKBCHUKDAPK3
SCHEMBL11620059 0.72 ALDH1A1 (0.42) LRRK2PRKACAIKBKBCHUKDAPK3
SCHEMBL11145305 0.71 ALDH1A1 (0.48) JAK2CDK5MAPTALDH1A1ADORA3
SCHEMBL321472 0.71 CCNA2 (0.44) LRRK2PRKACAIKBKBCHUKDAPK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122059956-A Non-classical iron death inhibitor and preparation method and application thereof 西南医科大学 2026-05-19 CN disclosed
CN-119219619-A Non-classical iron death inhibitor and preparation method and application thereof 四川大学 2024-12-31 CN disclosed
CN-118697933-A Preparation method and application of self-healing medical hydrogel 广西中医药大学 2024-09-27 CN disclosed
CN-116621999-B Extraction of banana flower polysaccharide and inhibition of banana flower polysaccharide on advanced glycosylation end products 中国热带农业科学院海口实验站 2024-08-13 CN disclosed
CN-116746657-A Sophorolipid composite edible emulsion and preparation method and application thereof 南京工业大学 2023-09-15 CN disclosed
CN-116621999-A Extraction of banana flower polysaccharide and inhibition of banana flower polysaccharide on advanced glycosylation end products 中国热带农业科学院海口实验站 2023-08-22 CN disclosed