SCHEMBL29565670

SCHEMBL29565670

CCN(CC)CCCCCCCCCCCCCCCCC(N)=O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PAOX Q6QHF9 1/20 0.52
SOAT1 P35610 2/20 0.45
MEN1 O00255 1/20 0.45
FAAH O00519 1/20 0.45
TP53 P04637 1/20 0.45
CYP1A2 P05177 1/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2C19 P33261 1/20 0.45
KMT2A Q03164 1/20 0.45
NPSR1 Q6W5P4 1/20 0.44
KDM5A P29375 4/20 0.43
KDM4C Q9H3R0 2/20 0.43
BCHE P06276 4/20 0.41
ACHE P22303 4/20 0.41
KDM4E B2RXH2 2/20 0.41
PHF8 Q9UPP1 2/20 0.40
APOBEC3A P31941 1/20 0.39
APOBEC3G Q9HC16 1/20 0.39
ALDH1A1 P00352 2/20 0.38
MAOB P27338 1/20 0.36

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
SCHEMBL4312640 1.00 PAOX (0.52) PAOXSOAT1MEN1FAAHTP53
SCHEMBL28431778 1.00 PAOX (0.52) PAOXSOAT1MEN1FAAHTP53
SCHEMBL29564926 1.00 PAOX (0.52) PAOXSOAT1MEN1FAAHTP53
SCHEMBL30773553 1.00 PAOX (0.52) PAOXSOAT1MEN1FAAHTP53
SCHEMBL6668912 0.98 PAOX (0.48) PAOXSOAT1MEN1FAAHTP53
SCHEMBL177754 0.91 NPSR1 (0.47) PAOXSOAT1MEN1FAAHTP53
SCHEMBL30773555 0.89 FAAH (0.65) SOAT1MEN1FAAHTP53CYP1A2
SCHEMBL30667437 0.85 SOAT1 (0.41) PAOXSOAT1MEN1FAAHTP53
Octadecanoic Acid Amide SCHEMBL2026272 0.85 SOAT1 (0.55) SOAT1MEN1FAAHTP53CYP1A2
SCHEMBL29642017 0.85 SOAT1 (0.50) SOAT1MEN1FAAHTP53CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024039639-A1 BIOMAG BASED EMULSION FOR COLD-IN-PLACE APPLICATIONS IOWA STATE UNIVERSITY RESEARCH FOUNDATION, INC. (US) 2024-02-22 WO disclosed
EP-4225836-A1 MAINTENANCE TREATMENTS USEFUL FOR IMPROVING THE PERFORMANCE OF AGED OR BRITTLE RESINOUS BINDERS IN PAVING OR ROOFING Iowa State University Research Foundation, Inc. (US) 2023-08-16 EP disclosed
WO-2022081558-A1 MAINTENANCE TREATMENTS USEFUL FOR IMPROVING THE PERFORMANCE OF AGED OR BRITTLE RESINOUS BINDERS IN PAVING OR ROOFING IOWA STATE UNIVERSITY RESEARCH FOUNDATION, INC. (US) 2022-04-21 WO disclosed