SCHEMBL31706571

SCHEMBL31706571

O=c1oc2cc(OCCO)ccc2c2c1CCCC2

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.77
KDM4E B2RXH2 4/20 0.77
HPGD P15428 4/20 0.77
HSD17B10 Q99714 4/20 0.77
MAPT P10636 4/20 0.77
TSHR P16473 1/20 0.77
MAPK1 P28482 1/20 0.77
RAB9A P51151 2/20 0.68
MEN1 O00255 1/20 0.68
KMT2A Q03164 1/20 0.68
USP2 O75604 1/20 0.68
FHIT P49789 1/20 0.67
TDP1 Q9NUW8 4/20 0.66
MAOB P27338 2/20 0.66
STS P08842 3/20 0.63
NPC1 O15118 1/20 0.63
POLB P06746 2/20 0.61
APEX1 P27695 1/20 0.61
L3MBTL1 Q9Y468 1/20 0.61
ACHE P22303 2/20 0.61

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
SCHEMBL25799533 1.00 ALDH1A1 (0.77) ALDH1A1KDM4EHPGDHSD17B10MAPT
SCHEMBL15973990 0.87 ALDH1A1 (0.77) ALDH1A1KDM4EHPGDHSD17B10MAPT
SCHEMBL15971776 0.87 ALDH1A1 (0.77) ALDH1A1KDM4EHPGDHSD17B10MAPT
SCHEMBL15971892 0.87 ALDH1A1 (0.77) ALDH1A1KDM4EHPGDHSD17B10MAPT
SCHEMBL15971987 0.86 ALDH1A1 (0.75) ALDH1A1KDM4EHPGDHSD17B10MAPT
SCHEMBL15974372 0.86 ALDH1A1 (0.75) ALDH1A1KDM4EHPGDHSD17B10MAPT
SCHEMBL11044109 0.86 ALDH1A1 (0.75) ALDH1A1KDM4EHPGDHSD17B10MAPT
SCHEMBL15973184 0.85 ALDH1A1 (0.73) ALDH1A1KDM4EHPGDHSD17B10MAPT
SCHEMBL13799892 0.83 ALDH1A1 (1.00) ALDH1A1KDM4EHPGDHSD17B10MAPT
SCHEMBL10503978 0.81 ALDH1A1 (0.67) ALDH1A1KDM4EHPGDHSD17B10MAPT

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-2025217275-A2 IMMUNE CELL TARGETED COMPOSITIONS AND RELATED METHODS FLAGSHIP PIONEERING INNOVATIONS VII, LLC (US) 2025-10-16 WO disclosed