SCHEMBL31323853

SCHEMBL31323853

CCN(CCCCO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C)C(CCCCCOC(=O)C1CCCCCCCCCCCCCC1)CCCCCOC(=O)C1CCCCCCCCCCCCCC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CHRM2 P08172 9/20 0.43
▸ CHRM1 P11229 9/20 0.43
▸ CHRM4 P08173 8/20 0.43
▸ CHRM3 P20309 8/20 0.43
▸ CYP3A4 P08684 3/20 0.36
▸ HTR1A P08908 2/20 0.35
▸ ADRA2A P08913 1/20 0.35
▸ DRD1 P21728 1/20 0.35
▸ SLC6A2 P23975 1/20 0.35
▸ ADRA1A P35348 1/20 0.35
▸ OPRM1 P35372 1/20 0.35
▸ DRD3 P35462 1/20 0.35
▸ SLC6A3 Q01959 1/20 0.35
▸ KCNH2 Q12809 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ CYP1A2 P05177 1/20 0.35
▸ CYP2D6 P10635 1/20 0.35
▸ TSHR P16473 1/20 0.35
▸ CHRM5 P08912 2/20 0.34
▸ SMN1; SMN2 Q16637 2/20 0.33

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
SCHEMBL31323820 0.90 CHRM2 (0.41) CHRM2CHRM1CHRM4CHRM3CYP3A4
SCHEMBL31323813 0.90 CHRM2 (0.41) CHRM2CHRM1CHRM4CHRM3CYP3A4
SCHEMBL31323837 0.84 CHRM2 (0.38) CHRM2CHRM1CHRM4CHRM3CYP3A4
SCHEMBL31323874 0.84 CHRM2 (0.38) CHRM2CHRM1CHRM4CHRM3CYP3A4
SCHEMBL31323821 0.82 CHRM2 (0.35) CHRM2CHRM1CHRM4CHRM3CYP3A4
SCHEMBL31323934 0.82 CHRM2 (0.35) CHRM2CHRM1CHRM4CHRM3CYP3A4
SCHEMBL31323825 0.78 CHRM2 (0.33) CHRM2CHRM1CHRM4CHRM3CYP3A4
SCHEMBL31323862 0.78 CHRM2 (0.40) CHRM2CHRM1CHRM4CHRM3CYP3A4
SCHEMBL31323865 0.78 CHRM2 (0.33) CHRM2CHRM1CHRM4CHRM3CYP3A4
SCHEMBL31323910 0.78 CHRM2 (0.35) CHRM2CHRM1CHRM4CHRM3ALDH1A1

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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