SCHEMBL24587247

SCHEMBL24587247

CCC(=O)OCCC(O)COC(=O)CC

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.45
KDM4E B2RXH2 2/20 0.41
DUSP3 P51452 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
LMNA P02545 1/20 0.41
ALDH1A1 P00352 1/20 0.37
CYP1A2 P05177 1/20 0.37
HPGD P15428 1/20 0.37
CYP2C19 P33261 1/20 0.37
BLM P54132 1/20 0.37
WRN Q14191 1/20 0.37
HIF1A Q16665 1/20 0.37
GAA P10253 1/20 0.36
ENPP2 Q13822 3/20 0.36
LPAR6 P43657 1/20 0.36
LPAR1 Q92633 1/20 0.36
LPAR4 Q99677 1/20 0.36
LPAR5 Q9H1C0 1/20 0.36
LPAR2 Q9HBW0 1/20 0.36

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
SCHEMBL24586198 1.00 NAAA (0.45) NAAAKDM4EDUSP3MEN1KMT2A
SCHEMBL20640481 0.85 KDM4E (0.46) NAAAKDM4EDUSP3MEN1KMT2A
SCHEMBL2256268 0.85 NAAA (0.47) NAAAKDM4EALDH1A1CYP1A2HPGD
SCHEMBL9463770 0.84 KDM4E (0.47) NAAAKDM4EDUSP3MEN1KMT2A
SCHEMBL14346367 0.81 NAAA (0.42) NAAAKDM4EDUSP3MEN1KMT2A
SCHEMBL586987 0.80 KDM4E (0.44) NAAAKDM4EDUSP3MEN1KMT2A
SCHEMBL992127 0.80 KDM4E (0.44) NAAAKDM4EDUSP3MEN1KMT2A
SCHEMBL24586928 0.80 NAAA (0.50) NAAAKDM4EALDH1A1CYP1A2HPGD
SCHEMBL28154352 0.80 NAAA (0.50) NAAAKDM4EALDH1A1CYP1A2HPGD
SCHEMBL992128 0.80 KDM4E (0.44) NAAAKDM4EDUSP3MEN1KMT2A

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-2022140458-A1 PENETRATING CRYOPROTECTION AGENTS AND METHODS OF MAKING AND USING SAME THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YORK (US) 2022-06-30 WO disclosed