SCHEMBL29093754

SCHEMBL29093754

CCc1sccc1P(C1CCCC1)C1CCCC1

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
DRD2 P14416 1/20 0.30
DRD3 P35462 1/20 0.30

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
SCHEMBL29093257 0.98 ROCK2 (0.31) KDM4EALDH1A1DRD2DRD3
SCHEMBL29093105 0.77 NPC1 (0.32) ALDH1A1
SCHEMBL29093752 0.75 NPC1 (0.31) ALDH1A1
SCHEMBL30576302 0.75
SCHEMBL29093533 0.74 KEAP1 (0.31)
SCHEMBL30576259 0.73
SCHEMBL29093215 0.72 ROCK2 (0.34)
SCHEMBL29093187 0.71
SCHEMBL29093523 0.71 KEAP1 (0.32)
SCHEMBL4839882 0.68 KEAP1 (0.31)

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
CN-116948067-A Catalyst for propylene polymerization and propylene polymerization or copolymerization reaction method 中国石油天然气股份有限公司 2023-10-27 CN claimed
CN-116948067-A Catalyst for propylene polymerization and propylene polymerization or copolymerization reaction method 中国石油天然气股份有限公司 2023-10-27 CN disclosed