SCHEMBL31436085

SCHEMBL31436085

CC(C)(C)OC(=O)NCCCNc1nc(NCCCNC(=O)OC(C)(C)C)nc(NCCN2CCCCC2)n1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.46
BACE1 P56817 1/20 0.46
STK17B O94768 1/20 0.46
STK17A Q9UEE5 1/20 0.46
DRD2 P14416 11/20 0.45
ADORA2A P29274 1/20 0.43
ADORA2B P29275 1/20 0.43
ADORA1 P30542 1/20 0.43
SIGMAR1 Q99720 2/20 0.43
TDP1 Q9NUW8 1/20 0.42
CHRM2 P08172 2/20 0.41
CHRM4 P08173 2/20 0.41
CHRM5 P08912 2/20 0.41
CHRM1 P11229 2/20 0.41
CHRM3 P20309 2/20 0.41

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
SCHEMBL31436126 0.99 STK17B (0.46) ACHEBACE1STK17BSTK17ADRD2
SCHEMBL31436105 0.91 DRD2 (0.47) STK17BSTK17ADRD2ADORA2AADORA2B
SCHEMBL31436045 0.88 BRD4 (0.49) BACE1STK17BSTK17ADRD2ADORA2A
SCHEMBL31436068 0.87 STK17B (0.43) STK17BSTK17ADRD2ADORA2AADORA2B
SCHEMBL31436111 0.85 DRD2 (0.44) ACHEBACE1STK17BSTK17ADRD2
SCHEMBL31436060 0.84 STK17B (0.58) STK17BSTK17AADORA2AADORA2BADORA1
SCHEMBL4743239 0.82 ACHE (0.58) ACHEBACE1DRD2SIGMAR1TDP1
SCHEMBL7220892 0.82 DRD2 (0.55) ACHEBACE1DRD2TDP1CHRM2
SCHEMBL485945 0.82 DRD2 (0.55) ACHEBACE1DRD2TDP1CHRM2
SCHEMBL31596990 0.81 DRD2 (0.58) ACHEBACE1DRD2SIGMAR1TDP1

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-2025088570-A1 IONIZABLE LIPIDS AND IONIZABLE LIPID NANOPARTICLES CRISPR THERAPEUTICS AG (CH) 2025-05-01 WO disclosed