SCHEMBL26319552

SCHEMBL26319552

CCOC(C)C(=O)NC(C)CCCC(OC)C(=O)NC(C)C

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ACACB O00763 1/20 0.33
MEN1 O00255 1/20 0.31
FAAH O00519 1/20 0.31
MAPK1 P28482 1/20 0.31
KMT2A Q03164 1/20 0.31
TAS1R3 Q7RTX0 1/20 0.31
TAS1R1 Q7RTX1 1/20 0.31
TAS1R2 Q8TE23 1/20 0.31

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
SCHEMBL26328041 0.83 HRH3 (0.32) MAPK1
SCHEMBL2120079 0.78 MEN1 (0.41) ACACBMEN1FAAHMAPK1KMT2A
SCHEMBL25447596 0.77 HDAC7 (0.38) MEN1FAAHMAPK1KMT2ATAS1R3
SCHEMBL26319558 0.69 ALDH1A1 (0.37) MEN1FAAHMAPK1KMT2A
SCHEMBL19010456 0.68
SCHEMBL2120342 0.67 MEN1 (0.46) MEN1FAAHMAPK1KMT2A
SCHEMBL2119927 0.66 MEN1 (0.39) ACACBMEN1FAAHMAPK1KMT2A
SCHEMBL2122233 0.65 CA12 (0.42) ACACBMEN1FAAHMAPK1KMT2A
SCHEMBL24848507 0.65 CA12 (0.42) ACACBMEN1FAAHMAPK1KMT2A
SCHEMBL18885420 0.65 CA12 (0.42) ACACBMEN1FAAHMAPK1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023164057-A1 DI-CYCLOPROPYL BASED IL-17A MODULATORS AND USES THEREOF DICE ALPHA, INC. (US) 2023-08-31 WO disclosed