SCHEMBL31323892

SCHEMBL31323892

CN(C)CCCC(=O)OC(CCCCC(=O)OC1CCCCCCCCCCCCCC1)CCCCC(=O)OC1CCCCCCCCCCCCCC1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NAAA Q02083 2/20 0.52
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ HTT P42858 1/20 0.36
▸ CYP2C19 P33261 1/20 0.35
▸ HDAC4 P56524 1/20 0.33
▸ HDAC1 Q13547 1/20 0.33
▸ EPHX1 P07099 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ ALDH1A1 P00352 3/20 0.33
▸ LMNA P02545 2/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ CYP19A1 P11511 1/20 0.32
▸ DNM1 Q05193 1/20 0.32
▸ SIGMAR1 Q99720 1/20 0.32
▸ EPHX2 P34913 2/20 0.32
▸ TSHR P16473 1/20 0.31
▸ CHRM2 P08172 1/20 0.31
▸ CHRM4 P08173 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
SCHEMBL15009576 0.99 NAAA (0.55) NAAASMN1; SMN2HTTCYP2C19HDAC4
SCHEMBL15026848 0.99 NAAA (0.55) NAAASMN1; SMN2HTTCYP2C19HDAC4
SCHEMBL16376200 0.99 NAAA (0.55) NAAASMN1; SMN2HTTCYP2C19HDAC4
SCHEMBL15027493 0.97 NAAA (0.54) NAAASMN1; SMN2HTTCYP2C19HDAC4
SCHEMBL15009586 0.97 NAAA (0.54) NAAASMN1; SMN2HTTCYP2C19HDAC4
SCHEMBL29190226 0.94 NAAA (0.64) NAAASMN1; SMN2MAPTMAPK1ALDH1A1
SCHEMBL15028238 0.94 NAAA (0.50) NAAASMN1; SMN2HDAC4HDAC1MAPT
SCHEMBL15028144 0.85 NAAA (0.40) NAAASMN1; SMN2MAPTMAPK1ALDH1A1
SCHEMBL25067393 0.85 NAAA (0.62) NAAASMN1; SMN2HTTCYP2C19EPHX1
SCHEMBL20924765 0.84 NAAA (0.58) NAAASMN1; SMN2HTTCYP2C19HDAC4

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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