SCHEMBL29280449

SCHEMBL29280449

CCCCCn1c(=O)c(C(=O)O)c(O)c2ccccc21

nearest known ligand 0.74

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.74
KMT2A Q03164 4/20 0.74
ALDH1A1 P00352 4/20 0.74
HTT P42858 4/20 0.72
KDM4E B2RXH2 4/20 0.70
LMNA P02545 3/20 0.70
TP53 P04637 1/20 0.70
HPGD P15428 1/20 0.70
MAPT P10636 1/20 0.69
SMN1; SMN2 Q16637 2/20 0.69
POLB P06746 2/20 0.69
TDP1 Q9NUW8 1/20 0.69
TYMS P04818 1/20 0.65
NPC1 O15118 1/20 0.65

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
SCHEMBL6126717 0.99 HTT (0.74) MEN1KMT2AALDH1A1HTTKDM4E
SCHEMBL27854528 0.96 MEN1 (0.74) MEN1KMT2AALDH1A1HTTKDM4E
SCHEMBL7435419 0.86 KDM4E (0.72) MEN1KMT2AALDH1A1HTTKDM4E
SCHEMBL7437388 0.85 ALDH1A1 (0.66) MEN1KMT2AALDH1A1HTTKDM4E
SCHEMBL9273857 0.85 MEN1 (0.76) MEN1KMT2AALDH1A1HTTKDM4E
SCHEMBL8361521 0.84 ALDH1A1 (1.00) MEN1KMT2AALDH1A1HTTKDM4E
SCHEMBL8357959 0.84 ALDH1A1 (1.00) MEN1KMT2AALDH1A1HTTKDM4E
SCHEMBL9591254 0.83 KDM4E (0.76) MEN1KMT2AALDH1A1HTTKDM4E
SCHEMBL6128980 0.83 MEN1 (0.84) MEN1KMT2AALDH1A1HTTKDM4E
SCHEMBL27854540 0.82 L3MBTL1 (0.69) MEN1KMT2AALDH1A1HTTKDM4E

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
CN-117750959-A 1, 2-dihydroquinolin-2-one for use in the treatment of limb muscular dystrophy 高级科学研究委员会 2024-03-22 CN disclosed