SCHEMBL30864883

SCHEMBL30864883

O=C1CCCCCc2[nH]ncc2C1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRIM24 O15164 2/20 0.36
TRIM33 Q9UPN9 2/20 0.36
ALDH1A1 P00352 2/20 0.36
DAPK3 O43293 2/20 0.35
LTK P29376 2/20 0.35
MAP2K2 P36507 2/20 0.35
MAPK8 P45983 2/20 0.35
CSNK1A1 P48729 2/20 0.35
CDK8 P49336 2/20 0.35
CDK5 Q00535 2/20 0.35
MAP2K1 Q02750 2/20 0.35
PTK2 Q05397 2/20 0.35
ROCK1 Q13464 2/20 0.35
DYRK1A Q13627 2/20 0.35
LRRK2 Q5S007 2/20 0.35
CAMK1D Q8IU85 2/20 0.35
CLK4 Q9HAZ1 2/20 0.35
DYRK1B Q9Y463 2/20 0.35
JAK2 O60674 1/20 0.35
CSF1R P07333 1/20 0.35

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
SCHEMBL31687191 1.00 TRIM24 (0.36) TRIM24TRIM33ALDH1A1DAPK3LTK
SCHEMBL31687183 1.00 TRIM24 (0.36) TRIM24TRIM33ALDH1A1DAPK3LTK
SCHEMBL31687193 1.00 TRIM24 (0.36) TRIM24TRIM33ALDH1A1DAPK3LTK
SCHEMBL12643298 0.86 CYP2A6 (0.39) DAPK3LTKMAP2K2MAPK8CSNK1A1
SCHEMBL31687184 0.80 KDR (0.41) ALDH1A1DAPK3LTKMAP2K2MAPK8
SCHEMBL31496664 0.80 KDR (0.41) ALDH1A1DAPK3LTKMAP2K2MAPK8
SCHEMBL4948667 0.80 KDR (0.41) ALDH1A1DAPK3LTKMAP2K2MAPK8
SCHEMBL29649189 0.80 KDR (0.41) ALDH1A1DAPK3LTKMAP2K2MAPK8
SCHEMBL30994991 0.79 TRIM24 (0.39) TRIM24TRIM33ALDH1A1DAPK3LTK
SCHEMBL10509 0.78

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4620959-A1 CYCLIC COMPOUNDS USED AS MULTI-TARGET KINASE INHIBITORS AND PREPARATION METHOD THEREFOR Shanghai Institute of Organic Chemistry, Chinese Academy of Sciences (CN) 2025-09-24 EP disclosed
CN-118084923-A Cyclic compounds as LRRK2 kinase inhibitors and methods of making the same 中国科学院上海有机化学研究所 2024-05-28 CN disclosed