SCHEMBL31323834

SCHEMBL31323834

CCCCCCCCC(CCCCCC)COC(=O)CCCCC(CCCCC(=O)OC1CCCCCCCCCCCCCC1)N(C)CCCCO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NAAA Q02083 2/20 0.40
▸ CHRM2 P08172 4/20 0.33
▸ CHRM4 P08173 4/20 0.33
▸ CHRM1 P11229 4/20 0.33
▸ CHRM3 P20309 4/20 0.33
▸ PPARG P37231 3/20 0.32
▸ PRSS1 P07477 1/20 0.32
▸ PRSS2 P07478 1/20 0.32
▸ PRSS3 P35030 1/20 0.32
▸ CYP3A4 P08684 2/20 0.31
▸ PPARA Q07869 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ ATM Q13315 1/20 0.31
▸ TDP1 Q9NUW8 1/20 0.31
▸ TBXA2R P21731 1/20 0.31
▸ ICMT O60725 1/20 0.30
▸ ALB P02768 1/20 0.30
▸ HTT P42858 1/20 0.30
▸ SMN1; SMN2 Q16637 1/20 0.30
▸ CNR2 P34972 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
SCHEMBL31323863 0.90 NAAA (0.37) NAAACHRM2CHRM4CHRM1CHRM3
SCHEMBL31323829 0.86 NAAA (0.41) NAAAPPARGPRSS1PRSS2PRSS3
SCHEMBL30842641 0.82 TLR2 (0.40) —
SCHEMBL31323958 0.81 CHRM2 (0.40) CHRM2CHRM4CHRM1CHRM3CYP3A4
SCHEMBL31035752 0.81 — —
SCHEMBL31323854 0.80 NAAA (0.53) NAAACYP3A4TSHRATMTDP1
SCHEMBL30837981 0.80 TLR2 (0.32) CHRM2CHRM4CHRM1CHRM3PPARG
SCHEMBL30900176 0.79 PPARG (0.34) PPARGPPARACNR2
SCHEMBL31323862 0.79 CHRM2 (0.40) CHRM2CHRM4CHRM1CHRM3CYP3A4
SCHEMBL31323820 0.78 CHRM2 (0.41) CHRM2CHRM4CHRM1CHRM3CYP3A4

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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