SCHEMBL23665372

SCHEMBL23665372

Cc1sc(C)c2c1C(=O)N(CC(C)C)C2=O

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.33
ALDH1A1 P00352 7/20 0.33
EP300 Q09472 2/20 0.33
MPO P05164 1/20 0.33
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
RGS4 P49798 3/20 0.32
RGS8 P57771 2/20 0.32
MAPT P10636 4/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
RAB9A P51151 3/20 0.31
NPC1 O15118 2/20 0.31
TDP1 Q9NUW8 1/20 0.31
KDM4E B2RXH2 1/20 0.31
HPGD P15428 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
PIK3CD O00329 1/20 0.31
CYP3A4 P08684 1/20 0.30
CYP2C9 P11712 1/20 0.30
MAPK1 P28482 1/20 0.30

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
SCHEMBL23665440 0.77 EP300 (0.40) GAAALDH1A1EP300MPOMEN1
SCHEMBL15977327 0.75 ALDH1A1 (0.41) GAAALDH1A1EP300MPOMEN1
SCHEMBL1814738 0.72 CA9 (0.40) ALDH1A1EP300MPOMEN1KMT2A
SCHEMBL10935097 0.72 CA9 (0.38) GAAEP300MPOPIK3CDTOP2A
SCHEMBL16307283 0.72 LMNA (0.35) ALDH1A1MEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL16604924 0.71 LMNA (0.34) ALDH1A1MEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL23665371 0.71 ALDH1A1 (0.37) GAAALDH1A1MEN1KMT2AMAPT
SCHEMBL19833544 0.69 MEN1 (0.40) GAAALDH1A1EP300MEN1KMT2A
SCHEMBL4459368 0.69 TRPA1 (0.41) GAAALDH1A1EP300MPOMEN1
SCHEMBL4466937 0.68 DPP4 (0.45) ALDH1A1MEN1KMT2ARAB9ANPC1

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-2021143690-A1 OSMIUM-CONTAINING CONJUGATED POLYMER, PREPARATION METHOD THEREFOR AND USE THEREOF 厦门大学 2021-07-22 WO disclosed