SCHEMBL25703117

SCHEMBL25703117

CCCC(=O)ON(O)CCC

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.48
KDM6B O15054 1/20 0.40
KDM5C P41229 1/20 0.40
EGLN1 Q9GZT9 1/20 0.40
PHF8 Q9UPP1 1/20 0.40
KDM2A Q9Y2K7 1/20 0.40
CES2 O00748 1/20 0.36
CES1 P23141 1/20 0.36
HDAC3 O15379 4/20 0.35
HDAC1 Q13547 4/20 0.35
HDAC2 Q92769 4/20 0.35
HDAC8 Q9BY41 4/20 0.35
FFAR3 O14843 3/20 0.35
TSHR P16473 2/20 0.33
CA12 O43570 1/20 0.33
CA2 P00918 1/20 0.33
CA9 Q16790 1/20 0.33
HPGD P15428 1/20 0.33
DNM1 Q05193 1/20 0.32
MEN1 O00255 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
SCHEMBL28245785 0.79 ALDH1A1 (0.50) ALDH1A1KDM6BKDM5CEGLN1PHF8
SCHEMBL28937863 0.76 ALDH1A1 (0.52) ALDH1A1KDM6BKDM5CEGLN1PHF8
SCHEMBL291621 0.73
SCHEMBL29948771 0.73 ALDH1A1 (0.55) ALDH1A1KDM6BKDM5CEGLN1PHF8
Hydrochloric Acid SCHEMBL519616 0.71 KDM6B (0.60) ALDH1A1KDM6BKDM5CEGLN1PHF8
SCHEMBL17686889 0.71 ALDH1A1 (0.52) ALDH1A1KDM6BKDM5CEGLN1PHF8
SCHEMBL28466573 0.71 KDM6B (0.43) ALDH1A1KDM6BKDM5CEGLN1PHF8
SCHEMBL29163447 0.71 ALDH1A1 (0.46) ALDH1A1KDM6BKDM5CEGLN1PHF8
SCHEMBL17686900 0.70 ALDH1A1 (0.50) ALDH1A1KDM6BKDM5CEGLN1PHF8
SCHEMBL4760570 0.70 ALDH1A1 (0.50) ALDH1A1KDM6BKDM5CEGLN1PHF8

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-2023081765-A2 PRODRUG COPOLYMERS AND POLYMERIC MICELLES THEREOF FOR THE DELIVERY OF SHORT-CHAIN FATTY ACIDS, THE PROMOTION OF GUT HEALTH, AND THE TREATMENT OF IMMUNE AND/OR INFLAMMATORY CONDITIONS AND FOOD ALLERGY THE UNIVERSITY OF CHICAGO (US) 2023-05-11 WO disclosed