SCHEMBL31661130

SCHEMBL31661130

CCCOC(=O)CCCN1CCN(CCOCCO)CC1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ MAPT P10636 1/20 0.42
▸ MAPK1 P28482 1/20 0.42
▸ DGKA P23743 1/20 0.41
▸ HTR1A P08908 1/20 0.41
▸ EPHX2 P34913 1/20 0.41
▸ MGLL Q99685 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ HRH2 P25021 5/20 0.39
▸ HRH1 P35367 5/20 0.39
▸ TSHR P16473 1/20 0.38
▸ NAMPT P43490 1/20 0.37

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
SCHEMBL31661129 0.89 ALDH1A1 (0.46) ALDH1A1L3MBTL1MAPTMAPK1DGKA
SCHEMBL31661139 0.88 ALDH1A1 (0.45) ALDH1A1L3MBTL1MAPTMAPK1DGKA
SCHEMBL12879889 0.84 PAOX (0.49) ALDH1A1L3MBTL1MAPTMAPK1DGKA
SCHEMBL19034570 0.83 ALDH1A1 (0.55) ALDH1A1L3MBTL1MAPTMAPK1DGKA
SCHEMBL15461758 0.81 EPHX2 (0.39) ALDH1A1L3MBTL1MAPTMAPK1DGKA
Di(Hydroxyethyl)Ether SCHEMBL3746471 0.81 DGKA (0.52) ALDH1A1L3MBTL1MAPTMAPK1DGKA
SCHEMBL31507439 0.80 THRB (0.42) MAPTDGKAHTR1AEPHX2MGLL
SCHEMBL31507395 0.80 THRB (0.42) MAPTDGKAHTR1AEPHX2MGLL
SCHEMBL419258 0.79 ALDH1A1 (0.46) ALDH1A1L3MBTL1MAPTMAPK1DGKA
SCHEMBL674334 0.79 ALDH1A1 (0.46) ALDH1A1L3MBTL1MAPTMAPK1DGKA

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-2025151605-A1 IONIZABLE AMPHIPHILIC JANUS DENDRIMERS, DELIVERY SYSTEMS COMPRISING THEREOF, AND METHODS OF USE THEREOF THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2025-07-17 — — WO disclosed
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