SCHEMBL31323826

SCHEMBL31323826

CC(C)(C)[Si](OCCSCCNC(CCCCCOC(=O)C1CCCCCCCCCCCCCC1)CCCCCOC(=O)C1CCCCCCCCCCCCCC1)(c1ccccc1)c1ccccc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.36
▸ MAPT P10636 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ CHRM2 P08172 5/20 0.33
▸ CHRM4 P08173 5/20 0.33
▸ CHRM1 P11229 5/20 0.33
▸ CHRM3 P20309 5/20 0.33
▸ FKBP1A P62942 4/20 0.32
▸ CYP3A4 P08684 2/20 0.32
▸ HTT P42858 2/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ SMYD2 Q9NRG4 1/20 0.31
▸ TLR2 O60603 1/20 0.31
▸ TLR1 Q15399 1/20 0.31
▸ CHRM5 P08912 1/20 0.31
▸ NPC1 O15118 1/20 0.31
▸ CYP2D6 P10635 1/20 0.31
▸ CYP2C9 P11712 1/20 0.31
▸ CYP2C19 P33261 1/20 0.31
▸ HTR7 P34969 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
SCHEMBL31323934 0.91 CHRM2 (0.35) ALDH1A1MAPTL3MBTL1CHRM2CHRM4
SCHEMBL31323821 0.91 CHRM2 (0.35) ALDH1A1MAPTL3MBTL1CHRM2CHRM4
SCHEMBL31323825 0.88 CHRM2 (0.33) ALDH1A1MAPTL3MBTL1CHRM2CHRM4
SCHEMBL31323865 0.88 CHRM2 (0.33) ALDH1A1MAPTL3MBTL1CHRM2CHRM4
SCHEMBL31323877 0.88 KLK7 (0.37) ALDH1A1L3MBTL1CYP3A4HTTSMN1; SMN2
SCHEMBL30977766 0.79 CTSK (0.33) SMN1; SMN2
SCHEMBL31323861 0.79 TDP1 (0.35) ALDH1A1MAPTL3MBTL1CHRM2CHRM4
SCHEMBL31323846 0.78 KLK7 (0.40) ALDH1A1L3MBTL1CYP3A4HTTSMN1; SMN2
SCHEMBL31323820 0.78 CHRM2 (0.41) ALDH1A1MAPTL3MBTL1CHRM2CHRM4
SCHEMBL31323813 0.78 CHRM2 (0.41) ALDH1A1MAPTL3MBTL1CHRM2CHRM4

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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