SCHEMBL31323807

SCHEMBL31323807

CN(CCOCCO)C(CCCCCOC(=O)C1CCCCCCCCCCCCCC1)CCCCCOC(=O)C1CCCCCCCCCCCCCC1

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.32
▸ MEN1 O00255 2/20 0.31
▸ KMT2A Q03164 2/20 0.31
▸ THRB P10828 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ ADRB2 P07550 1/20 0.31
▸ ADRB1 P08588 1/20 0.31
▸ ADRB3 P13945 1/20 0.31
▸ CHRM2 P08172 1/20 0.30
▸ CHRM4 P08173 1/20 0.30
▸ CHRM1 P11229 1/20 0.30
▸ CHRM3 P20309 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
SCHEMBL31323838 1.00 ALDH1A1 (0.32) ALDH1A1MEN1KMT2ATHRBHTT
SCHEMBL31323831 0.88 CHRM2 (0.33) ALDH1A1MEN1KMT2AADRB2ADRB1
SCHEMBL31323901 0.88 CHRM2 (0.33) ALDH1A1MEN1KMT2AADRB2ADRB1
SCHEMBL31323932 0.84 ALDH1A1 (0.32) ALDH1A1MAPTADRB2ADRB1ADRB3
SCHEMBL31323937 0.82 SMN1; SMN2 (0.37) ALDH1A1MEN1KMT2AMAPT
SCHEMBL31323881 0.80 CHRM2 (0.36) ALDH1A1MEN1KMT2ATHRBHTT
SCHEMBL31323801 0.80 CHRM2 (0.36) ALDH1A1MEN1KMT2ATHRBHTT
SCHEMBL31323910 0.78 CHRM2 (0.35) ALDH1A1MEN1KMT2ACHRM2CHRM4
SCHEMBL23141734 0.74 ALDH1A1 (0.41) ALDH1A1MEN1KMT2AADRB2ADRB1
SCHEMBL15028294 0.74 ALDH1A1 (0.41) ALDH1A1MEN1KMT2AHTTADRB2

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-2025035202-A1 IONIZABLE LIPIDS COMPRISING MACROCYCLIC RINGS FOR THE DELIVERY OF THERAPEUTIC AGENTS NANOVATION THERAPEUTICS INC. (CA) 2025-02-20 — — WO disclosed
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