SCHEMBL29160983

SCHEMBL29160983

CCCCCCCCC(CCCCCCCC)C(O)(O)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSNK1E P49674 1/20 0.44
LIPG Q9Y5X9 1/20 0.43
FDPS P14324 1/20 0.43
PRSS1 P07477 3/20 0.42
CTSG P08311 2/20 0.42
CTRB1 P17538 2/20 0.42
CMA1 P23946 2/20 0.42
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
TTR P02766 1/20 0.41
ALDH1A1 P00352 1/20 0.40
CNR2 P34972 1/20 0.40
CYSLTR2 Q9NS75 1/20 0.39
CYSLTR1 Q9Y271 1/20 0.39
HTR2A P28223 1/20 0.38
PRSS2 P07478 1/20 0.38
PRSS3 P35030 1/20 0.38
KCNA5 P22460 1/20 0.38
KCNH2 Q12809 1/20 0.38
CES2 O00748 1/20 0.38

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
SCHEMBL29780652 1.00 CSNK1E (0.44) CSNK1ELIPGFDPSPRSS1CTSG
SCHEMBL23071492 0.86 MEN1 (0.41) FDPSPRSS1CTSGCTRB1CMA1
SCHEMBL28724613 0.80 MEN1 (0.45) CSNK1EFDPSPRSS1MEN1KMT2A
SCHEMBL11177019 0.80 CSNK1E (0.41) CSNK1EPRSS1CTSGCTRB1CMA1
SCHEMBL9725299 0.79 CSNK1E (0.41) CSNK1ELIPGFDPSPRSS1CTSG
SCHEMBL7603499 0.77 LMNA (0.41) CSNK1EPRSS1CTSGCTRB1CMA1
SCHEMBL5571348 0.77 MEN1 (0.47) CSNK1EFDPSPRSS1CTSGCTRB1
SCHEMBL7605249 0.77 LMNA (0.41) CSNK1EPRSS1CTSGCTRB1CMA1
SCHEMBL27517561 0.76 ALDH1A1 (0.43) MEN1KMT2ATTRALDH1A1CNR2
SCHEMBL5567107 0.75 MEN1 (0.53) FDPSPRSS1CTSGCTRB1CMA1

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-117363404-A Large pile foundation pore-forming casing pressure-pulling drag reducer 山东省公路桥梁建设集团有限公司 2024-01-09 CN claimed
CN-117363404-A Large pile foundation pore-forming casing pressure-pulling drag reducer 山东省公路桥梁建设集团有限公司 2024-01-09 CN disclosed