SCHEMBL28049574

SCHEMBL28049574

CC(=O)Oc1c(O)c2cc(NC(=O)Cc3ccccc3)ccc2n(C)c1=O

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.52
MMP13 P45452 1/20 0.45
NPY5R Q15761 3/20 0.45
ALDH1A1 P00352 4/20 0.44
MEN1 O00255 4/20 0.44
KMT2A Q03164 4/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
KDM4E B2RXH2 3/20 0.44
USP2 O75604 1/20 0.43
RAB9A P51151 4/20 0.43
MAPT P10636 1/20 0.43
NPC1 O15118 2/20 0.42
ROCK2 O75116 1/20 0.42
PKM P14618 1/20 0.42
HPGD P15428 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
SCHEMBL28825720 0.84 NTRK1 (0.53) ALDH1A1MEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL19086549 0.82 RAB9A (0.51) GAAMMP13NPY5RALDH1A1MEN1
SCHEMBL17578575 0.78 HIF1A (0.63) MEN1KMT2AL3MBTL1RAB9ANPC1
SCHEMBL7989247 0.77 MEN1 (0.47) GAAALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL4729139 0.77 NPY5R (0.64) NPY5RALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL6581634 0.75 ALDH1A1 (0.54) GAAALDH1A1SMN1; SMN2KDM4ERAB9A
SCHEMBL6578990 0.75 ALDH1A1 (0.64) GAAALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL7977901 0.72 ALDH1A1 (0.52) GAAALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL9317114 0.71 NTRK1 (0.73) GAAMMP13NPY5RALDH1A1MEN1
SCHEMBL6578834 0.70 KDM4E (0.52) GAAALDH1A1MEN1KMT2AL3MBTL1

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-105384687-A Quinolinone compound and application thereof in drugs GUANGDONG HEC PHARMACEUTICAL 2016-03-09 CN disclosed