SCHEMBL25753957

SCHEMBL25753957

CC1=C(CCCCCC(=O)NCC(=O)O)C(=O)c2ccccc2C1=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.46
APAF1 O14727 1/20 0.46
MITF O75030 1/20 0.46
ALDH1A1 P00352 1/20 0.46
LMNA P02545 1/20 0.46
MAPT P10636 1/20 0.46
HTT P42858 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
HDAC3 O15379 1/20 0.42
HDAC1 Q13547 1/20 0.42
HDAC2 Q92769 1/20 0.42
HDAC8 Q9BY41 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42
CDC25B P30305 2/20 0.42
MAP2K7 O14733 1/20 0.42
CDC25A P30304 1/20 0.42
FAAH O00519 1/20 0.42
F13A1 P00488 1/20 0.41

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
SCHEMBL25753852 0.95 LMNA (0.48) KDM4EAPAF1MITFALDH1A1LMNA
SCHEMBL29263294 0.85 MAPT (0.54) KDM4EAPAF1MITFALDH1A1LMNA
SCHEMBL9709635 0.85 MAPT (0.54) KDM4EAPAF1MITFALDH1A1LMNA
SCHEMBL30201802 0.85 MAPT (0.54) KDM4EAPAF1MITFALDH1A1LMNA
SCHEMBL21940525 0.85 MAPT (0.54) KDM4EAPAF1MITFALDH1A1LMNA
SCHEMBL25753979 0.85 ALDH1A1 (0.47) KDM4EAPAF1MITFALDH1A1LMNA
SCHEMBL25753950 0.85 PTPRC (0.47) KDM4EAPAF1MITFALDH1A1LMNA
SCHEMBL11421782 0.84 MAPT (0.55) KDM4EAPAF1MITFALDH1A1LMNA
SCHEMBL25753851 0.82 RECQL (0.49) KDM4EAPAF1MITFALDH1A1LMNA
SCHEMBL21939844 0.80 F13A1 (0.51) ALDH1A1MAPTHDAC3HDAC1HDAC2

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
EP-3615502-B1 THERAPEUTIC COMPOUNDS AND METHODS UNIV TASMANIA (AU) 2023-06-21 EP disclosed