SCHEMBL30180784

SCHEMBL30180784

CC(C)COC(=O)CCOCC(N)(COCCC(=O)OCC(C)C)COCCC(=O)OC(C)(C)C

nearest known ligand 0.31

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HDAC3 O15379 1/20 0.31
HDAC1 Q13547 1/20 0.31
HDAC2 Q92769 1/20 0.31
HDAC8 Q9BY41 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31
POLB P06746 1/20 0.30
GAA P10253 1/20 0.30
TSHR P16473 2/20 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
SCHEMBL15592442 0.91 TSHR (0.35) POLBGAATSHR
SCHEMBL944737 0.86 STING1 (0.33) HDAC3HDAC1HDAC2HDAC8HDAC6
SCHEMBL19509813 0.85 EPHX2 (0.32) POLBGAATSHR
SCHEMBL16329787 0.82 HDAC3 (0.33) HDAC3HDAC1HDAC2HDAC8HDAC6
SCHEMBL25887807 0.81 TSHR (0.39) HDAC3HDAC1HDAC2HDAC8HDAC6
SCHEMBL14361939 0.80 STING1 (0.31)
SCHEMBL29138749 0.80 STING1 (0.31)
SCHEMBL25495878 0.80 STING1 (0.31)
SCHEMBL14190503 0.77
SCHEMBL15568215 0.75

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
EP-4370157-A1 ASGPR CELL SURFACE RECEPTOR BINDING COMPOUNDS AND CONJUGATES Lycia Therapeutics, Inc. (US) 2024-05-22 EP disclosed
WO-2023288033-A1 ASGPR CELL SURFACE RECEPTOR BINDING COMPOUNDS AND CONJUGATES LYCIA THERAPEUTICS, INC. (US) 2023-01-19 WO disclosed