SCHEMBL24340893

SCHEMBL24340893

CC(C)(CNC(=O)CCN1C(=O)C=CC1=O)COCC(C)(C)CC(N)=O

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 1/20 0.32
PTGS1 P23219 4/20 0.31
PTGS2 P35354 4/20 0.31
AKT1 P31749 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 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
SCHEMBL22135513 0.89 MGLL (0.33) MGLLPTGS1PTGS2AKT1MEN1
SCHEMBL24340762 0.88 MGLL (0.32) MGLLPTGS1PTGS2AKT1MEN1
SCHEMBL24340732 0.88 MGLL (0.35) MGLLPTGS1PTGS2AKT1MEN1
SCHEMBL24340782 0.87 MGLL (0.34) MGLLPTGS1PTGS2AKT1MEN1
SCHEMBL25839706 0.85 AKT1 (0.33) MGLLAKT1MEN1KMT2A
SCHEMBL23207887 0.84
SCHEMBL26520141 0.83 MGLL (0.35) MGLLPTGS1PTGS2AKT1MEN1
SCHEMBL24340793 0.83 SMN1; SMN2 (0.41) MEN1KMT2A
SCHEMBL18544643 0.83 AKT1 (0.31) AKT1
SCHEMBL24183327 0.83

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-2022056273-A1 LIPID CONJUGATES FOR THE DELIVERY OF THERAPEUTIC AGENTS Arrowhead Pharmaceuticals, Inc. (US) 2022-03-17 WO disclosed